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Benzodiazepines

Description:

Organic compounds containing a benzene ring fused to either isomers of diazepine(unsaturated seven-member heterocycle with two nitrogen atoms replacing two carbon atoms).

Ancestors:

Organic compounds ⮕ Organoheterocyclic compounds ⮕ Benzodiazepines
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Items 97-108 of 154

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  1. Dibenzepine HCl
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 315-80-0
    Formula:  C16H17N3O•HCl        Molecular Weight: 303.793646
    IUPAC Name:  5-[2-(dimethylamino)ethyl]-11-methylbenzo[b][1,4]benzodiazepin-6-one;hydrochloride
    SMILES:  CN1C2=CC=CC=C2C(=O)N(C3=CC=CC=C31)CCN(C)C.Cl
    InChIKey: RJPZIQRLRMWPRF-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H21N3O.ClH/c1-19(2)12-13-21-17-11-7-6-10-16(17)20(3)15-9-5-4-8-14(15)18(21)22;/h4-11H,12-13H2,1-3H3;1H
    Synonyms: Dibenzepin hydrochloride|315-80-0|Dibenzepine HCl|Dibenzepine hydrochloride|Dibenzepin HCl|Noveril|Ansiopax|Neodalit|...
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  2. Dibenzepine HCl
      Grade & Purity: 
    • ≥99%
    Cas Number: 315-80-0
    Formula:  C16H17N3O•HCl        Molecular Weight: 303.793646
    IUPAC Name:  5-[2-(dimethylamino)ethyl]-11-methylbenzo[b][1,4]benzodiazepin-6-one;hydrochloride
    SMILES:  CN1C2=CC=CC=C2C(=O)N(C3=CC=CC=C31)CCN(C)C.Cl
    InChIKey: RJPZIQRLRMWPRF-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H21N3O.ClH/c1-19(2)12-13-21-17-11-7-6-10-16(17)20(3)15-9-5-4-8-14(15)18(21)22;/h4-11H,12-13H2,1-3H3;1H
    Synonyms: (E)-2-HEXENAL DIETHYL ACETAL [FHFI] | 10-(2-(dimethylamino)ethyl)-5-methyl-5H-dibenzo[b,e][1,4]diazepin-11(10H)-one h...
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  3. DREADD Agonist 21
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 56296-18-5
    Formula:  C17H18N4        Molecular Weight: 278.35
    IUPAC Name:  6-piperazin-1-yl-11H-benzo[b][1,4]benzodiazepine
    SMILES:  C1CN(CCN1)C2=NC3=CC=CC=C3NC4=CC=CC=C42
    InChIKey: JCBYXNSOLUVGTF-UHFFFAOYSA-N
    InChI:  InChI=1S/C17H18N4/c1-2-6-14-13(5-1)17(21-11-9-18-10-12-21)20-16-8-4-3-7-15(16)19-14/h1-8,18-19H,9-12H2
    Synonyms: 11-(piperazin-1-yl)-5H-dibenzo[b,e][1,4]diazepine | 11-Piperazinyldibenzo[b,e][1,4]diazepine dihydrochloride | Compou...
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  4. Cyclopeptine
    Cas Number: 50886-63-0
    Formula:  C17H16N2O2        Molecular Weight: 280.32
    IUPAC Name:  (3S)-3-benzyl-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione
    SMILES:  CN1C(C(=O)NC2=CC=CC=C2C1=O)CC3=CC=CC=C3
    InChIKey: KSQNKZMAMGACTL-HNNXBMFYSA-N
    InChI:  InChI=1S/C17H16N2O2/c1-19-15(11-12-7-3-2-4-8-12)16(20)18-14-10-6-5-9-13(14)17(19)21/h2-10,15H,11H2,1H3,(H,18,20)/t15-/m0/s1
    Synonyms: (3S)-3-benzyl-4-methyl-1,3-dihydro-1,4-benzodiazepine-2,5-dione | (3S)-3-benzyl-4-methyl-3,4-dihydro-1H-1,4-benzodiaz...
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  5. ClozapineN-Oxide
      Grade & Purity: 
    • ≥97%
    Cas Number: 34233-69-7
    Formula:  C18H19ClN4O        Molecular Weight: 342.82
    IUPAC Name:  3-chloro-6-(4-methyl-4-oxidopiperazin-4-ium-1-yl)-11H-benzo[b][1,4]benzodiazepine
    SMILES:  C[N+]1(CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)NC4=CC=CC=C42)[O-]
    InChIKey: OGUCZBIQSYYWEF-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H19ClN4O/c1-23(24)10-8-22(9-11-23)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
    Synonyms: N-Oxyclozapine | s4107 | UNII-MZA8BK588J | 1-[3-(dimethylamino) propyl]-1-(4-fluorophenyl)-1,3-dihydro-5-isobenzofura...
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  6. Clozapine
    Cas Number: 5786-21-0
    Formula:  C18H19ClN4        Molecular Weight: 326.82
    IUPAC Name:  3-chloro-6-(4-methylpiperazin-1-yl)-11H-benzo[b][1,4]benzodiazepine
    SMILES:  CN1CCN(CC1)C2=NC3=C(C=CC(=C3)Cl)NC4=CC=CC=C42
    InChIKey: QZUDBNBUXVUHMW-UHFFFAOYSA-N
    InChI:  InChI=1S/C18H19ClN4/c1-22-8-10-23(11-9-22)18-14-4-2-3-5-15(14)20-16-7-6-13(19)12-17(16)21-18/h2-7,12,20H,8-11H2,1H3
    Synonyms: Clozapine (JAN/USP/INN) | HSDB 6478 | Prestwick1_000350 | Clozapine (Clozaril) | Clozapina [INN-Spanish] | KBio2_0054...
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  7. CPI-637
      Grade & Purity: 
    • ≥99%
    Cas Number: 1884712-47-3
    Formula:  C22H22N6O        Molecular Weight: 386.45
    IUPAC Name:  (4R)-4-methyl-6-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
    SMILES:  CC1CC(=O)NC2=CC=CC(=C2N1)C3=CC4=C(C=C3)N(N=C4C5=CN(N=C5)C)C
    InChIKey: BFTKDWYIRJGJCA-CYBMUJFWSA-N
    InChI:  InChI=1S/C22H22N6O/c1-13-9-20(29)25-18-6-4-5-16(22(18)24-13)14-7-8-19-17(10-14)21(26-28(19)3)15-11-23-27(2)12-15/h4-8,10-13,24H,9H2,1-3H3,(H,25,29)/t1show more
    Synonyms: (S)-4-methyl-6-(1-methyl-3-(1-methyl-1H-pyrazol-4-yl)-1H-indazol-5-yl)-4,5-dihydro-1H-benzo[b][1,4]diazepin-2(3H)-one
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  8. CPI-637
      Grade & Purity: 
    • 10mM in DMSO
    Cas Number: 1884712-47-3
    Formula:  C22H22N6O        Molecular Weight: 386.45
    IUPAC Name:  (4R)-4-methyl-6-[1-methyl-3-(1-methylpyrazol-4-yl)indazol-5-yl]-1,3,4,5-tetrahydro-1,5-benzodiazepin-2-one
    SMILES:  CC1CC(=O)NC2=CC=CC(=C2N1)C3=CC4=C(C=C3)N(N=C4C5=CN(N=C5)C)C
    InChIKey: BFTKDWYIRJGJCA-CYBMUJFWSA-N
    InChI:  InChI=1S/C22H22N6O/c1-13-9-20(29)25-18-6-4-5-16(22(18)24-13)14-7-8-19-17(10-14)21(26-28(19)3)15-11-23-27(2)12-15/h4-8,10-13,24H,9H2,1-3H3,(H,25,29)/t1show more
    Synonyms: 2H-​1,​5-​Benzodiazepin-​2-​one,1,​3,​4,​5-​tetrahydro-​4-​methyl-​6-​[1-​methyl-​3-​(1-​methyl-​1H-​pyrazol-​4-​yl)​-...
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  9. CFM 2
      Grade & Purity: 
    • ≥98%
    Cas Number: 178616-26-7
    Formula:  C17H17N3O3        Molecular Weight: 311.34
    IUPAC Name:  1-(4-aminophenyl)-7,8-dimethoxy-3,5-dihydro-2,3-benzodiazepin-4-one
    SMILES:  COC1=C(C=C2C(=C1)CC(=O)NN=C2C3=CC=C(C=C3)N)OC
    InChIKey: MJKADKZSYQWGLL-UHFFFAOYSA-N
    InChI:  InChI=1S/C17H17N3O3/c1-22-14-7-11-8-16(21)19-20-17(13(11)9-15(14)23-2)10-3-5-12(18)6-4-10/h3-7,9H,8,18H2,1-2H3,(H,19,21)
    Synonyms: CFM-2 | HMS3412G05 | HY-12503 | A911180 | NCGC00024988-01 | CFM2;CFM 2 | FT-0711883 | 1-(4-Amino-phenyl)-7,8-dimethox...
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  10. Bz 423
    Cas Number: 216691-95-1
    Formula:  C27H21ClN2O2        Molecular Weight: 440.92
    IUPAC Name:  7-chloro-5-(4-hydroxyphenyl)-1-methyl-3-(naphthalen-2-ylmethyl)-3H-1,4-benzodiazepin-2-one
    SMILES:  CN1C2=C(C=C(C=C2)Cl)C(=NC(C1=O)CC3=CC4=CC=CC=C4C=C3)C5=CC=C(C=C5)O
    InChIKey: HIJCSNHREFFOML-UHFFFAOYSA-N
    InChI:  InChI=1S/C27H21ClN2O2/c1-30-25-13-10-21(28)16-23(25)26(19-8-11-22(31)12-9-19)29-24(27(30)32)15-17-6-7-18-4-2-3-5-20(18)14-17/h2-14,16,24,31H,15H2,1H3
    Synonyms: 2H-1,4-Benzodiazepin-2-one, 7-chloro-1,3-dihydro-5-(4-hydroxyphenyl)-1-methyl-3-(2-naphthalenylmethyl)- (9CI) | 7-Chl...
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  11. 8-Chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione
      Grade & Purity: 
    • ≥95%
    Cas Number: 195983-60-9
    Formula:  C9H7ClN2O2        Molecular Weight: 210.62
    IUPAC Name:  8-chloro-3,4-dihydro-1H-1,4-benzodiazepine-2,5-dione
    SMILES:  C1C(=O)NC2=C(C=CC(=C2)Cl)C(=O)N1
    InChIKey: FAVPJIZQGHYIEW-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H7ClN2O2/c10-5-1-2-6-7(3-5)12-8(13)4-11-9(6)14/h1-3H,4H2,(H,11,14)(H,12,13)
    Synonyms: 8-Chloro-3,4-dihydro-1H-benzo[e][1,4]diazepine-2,5-dione, AldrichCPR | Oprea1_301994 | VHA98360 | 8-chloranyl-3,4-dih...
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  12. 7-Fluoro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine
      Grade & Purity: 
    • ≥95%
    Cas Number: 886366-21-8
    Formula:  C9H11FN2        Molecular Weight: 166.199
    IUPAC Name:  7-fluoro-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine
    SMILES:  C1CNC2=C(CN1)C=C(C=C2)F
    InChIKey: NNXGSKKLUSOLHT-UHFFFAOYSA-N
    InChI:  InChI=1S/C9H11FN2/c10-8-1-2-9-7(5-8)6-11-3-4-12-9/h1-2,5,11-12H,3-4,6H2
    Synonyms: Q-102434 | MFCD07369955 | AS-37738 | 7-Fluoro-2,3,4,5-tetrahydro-1H-benzo[e][1,4]diazepine | DTXSID30649668 | FT-0770...
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