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Benzoxadiazoles
Description:
Organic compounds containing a benzene fused to an oxadiazole ring (a five-membered ring with two carbon atoms, one nitrogen atom, and one oxygen atom).
Ancestors:
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2,1,3-Benzoxadiazole-5-CarbonylchlorideCas Number: 126147-86-2Formula: C7H3ClN2O2 Molecular Weight: 182.57IUPAC Name: 2,1,3-benzoxadiazole-5-carbonyl chlorideSMILES: C1=CC2=NON=C2C=C1C(=O)ClInChIKey: ODCMBRSQNVPDOK-UHFFFAOYSA-NInChI: InChI=1S/C7H3ClN2O2/c8-7(11)4-1-2-5-6(3-4)10-12-9-5/h1-3HSynonyms: PS-10756 | 2-(4-AMINO-BENZENESULFONYLAMINO)-3-PHENYL-PROPIONICACID | benzo[c][1,2,5]oxadiazole-5-carbonyl chloride | ... -
(S)-(+)-4-(N，N-Dimethylaminosulfonyl)-7-(3-isothiocyanatopyrrolidin-1-yl)-2，1，3-benzoxadiazoleCas Number: 163927-32-0 Compound CID: 16218753Formula: C13H15N5O3S2 Molecular Weight: 353.42IUPAC Name: 7-[(3S)-3-isothiocyanatopyrrolidin-1-yl]-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamideSMILES: CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N3CCC(C3)N=C=SInChIKey: YMXYIIXTKUQWPC-VIFPVBQESA-NInChI: InChI=1S/C13H15N5O3S2/c1-17(2)23(19,20)11-4-3-10(12-13(11)16-21-15-12)18-6-5-9(7-18)14-8-22/h3-4,9H,5-7H2,1-2H3/t9-/m0/s1Synonyms: (S)-(+)-DBD-PY-NCS [=(S)-(+)-4-(N,N-DIMETHYLAMINOSULFONYL)-7-(3-ISOTHIOCYANATOPYRROLIDIN-1-YL)-2,1,3-BENZOXADIAZOLE] ... -
(S)-(+)-DBD-APy [=(S)-(+)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,1,3-benzoxadiazole] [HPLC Labeling Reagent for e.e. Determination]Cas Number: 143112-50-9 Compound CID: 15682839Formula: C12H17N5O3S Molecular Weight: 311.36IUPAC Name: 7-[(3S)-3-aminopyrrolidin-1-yl]-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamideSMILES: CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N3CCC(C3)NInChIKey: SZJGHUNJZRXXCA-QMMMGPOBSA-NInChI: InChI=1S/C12H17N5O3S/c1-16(2)21(18,19)10-4-3-9(11-12(10)15-20-14-11)17-6-5-8(13)7-17/h3-4,8H,5-7,13H2,1-2H3/t8-/m0/s1Synonyms: D88576 | 7-[(3S)-3-Aminopyrrolidin-1-yl]-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamide | (S)-(+)-4-(N,N-Dimethylami...
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4-Fluoro-2，1，3-benzoxadiazoleCas Number: 29270-55-1Formula: C6H3FN2O Molecular Weight: 138.1IUPAC Name: 4-fluoro-2,1,3-benzoxadiazoleSMILES: C1=CC2=NON=C2C(=C1)FInChIKey: QKZQJBBZKDVVFI-UHFFFAOYSA-NInChI: InChI=1S/C6H3FN2O/c7-4-2-1-3-5-6(4)9-10-8-5/h1-3HSynonyms: 4-Fluoro-2,1,3-benzoxadiazole|29270-55-1|4-Fluoro-2,1,3-benzoxadiazol|4-Fluorobenzo[c][1,2,5]oxadiazole|4-Fluorobenzo...
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4-Chloro-7-nitro-1,2,3-benzoxadiazoleCas Number: 10199-89-0 EC Number: 233-496-4Formula: C6H2CLN3O3 Molecular Weight: 199.55IUPAC Name: 4-chloro-7-nitro-2,1,3-benzoxadiazoleSMILES: C1=C(C2=NON=C2C(=C1)Cl)[N+](=O)[O-]InChIKey: IGHBXJSNZCFXNK-UHFFFAOYSA-NInChI: InChI=1S/C6H2ClN3O3/c7-3-1-2-4(10(11)12)6-5(3)8-13-9-6/h1-2HSynonyms: NBD-Cl | 4-Chloro-7-nitrobenzofurazan, BioReagent, suitable for fluorescence, >=97.0% (HPLC) | DTXSID2064995 | 1-Chlo...
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(R)-(-)-DBD-APy [=(R)-(-)-4-(N,N-Dimethylaminosulfonyl)-7-(3-aminopyrrolidin-1-yl)-2,1,3-benzoxadiazole] [HPLC Labeling Reagent for e.e. Determination]Cas Number: 143112-49-6 Compound CID: 15682838Formula: C12H17N5O3S Molecular Weight: 311.36IUPAC Name: 7-[(3R)-3-aminopyrrolidin-1-yl]-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamideSMILES: CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)N3CCC(C3)NInChIKey: SZJGHUNJZRXXCA-MRVPVSSYSA-NInChI: InChI=1S/C12H17N5O3S/c1-16(2)21(18,19)10-4-3-9(11-12(10)15-20-14-11)17-6-5-8(13)7-17/h3-4,8H,5-7,13H2,1-2H3/t8-/m1/s1Synonyms: MFCD00191379 | (R)-7-(3-aminopyrrolidin-1-yl)-N,N-dimethylbenzo[c][1,2,5]oxadiazole-4-sulfonamide | 7-[(3R)-3-Aminopy...
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4-Chloro-7-chlorosulfonyl-2,1,3-benzoxadiazoleCas Number: 142246-48-8Formula: C6H2Cl2N2O3S Molecular Weight: 253.05IUPAC Name: 4-chloro-2,1,3-benzoxadiazole-7-sulfonyl chlorideSMILES: C1=C(C2=NON=C2C(=C1)Cl)S(=O)(=O)ClInChIKey: BPPRLMZEVZSIIJ-UHFFFAOYSA-NInChI: InChI=1S/C6H2Cl2N2O3S/c7-3-1-2-4(14(8,11)12)6-5(3)9-13-10-6/h1-2HSynonyms: 4-Chloro-7-chlorosulfonyl-2,1,3-benzoxadiazole | AKOS000303237 | BB 0260632 | EN300-222516 | 4-Chloro-7-chlorosulfony...
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4-Chloro-2,1,3-benzoxadiazoleCas Number: 7116-16-7Formula: C6H3ClN2O Molecular Weight: 154.55IUPAC Name: 4-chloro-2,1,3-benzoxadiazoleSMILES: C1=CC2=NON=C2C(=C1)ClInChIKey: YLEBWUGKYMZPQQ-UHFFFAOYSA-NInChI: InChI=1S/C6H3ClN2O/c7-4-2-1-3-5-6(4)9-10-8-5/h1-3HSynonyms: SCHEMBL3893783 | D76750 | 4-Chlorobenzofurazan | 4-chlorobenzo[c][1,2,5]oxadiazole | STK780007 | CCG-321567 | 7-chlor...
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4-Benzylamino-7-nitro-2,1,3-benzoxadiazoleCas Number: 18378-20-6 EC Number: 242-261-5Formula: C13H10N4O3 Molecular Weight: 270.24IUPAC Name: N-benzyl-4-nitro-2,1,3-benzoxadiazol-7-amineSMILES: C1=CC=C(C=C1)CNC2=CC=C(C3=NON=C23)[N+](=O)[O-]InChIKey: GZFKJMWBKTUNJS-UHFFFAOYSA-NInChI: InChI=1S/C13H10N4O3/c18-17(19)11-7-6-10(12-13(11)16-20-15-12)14-8-9-4-2-1-3-5-9/h1-7,14H,8H2Synonyms: BBD | 7-nitro-N-(phenylmethyl)-2,1,3-benzoxadiazol-4-amine | Oprea1_072887 | Oprea1_055125 | N-benzyl-7-nitro-2,1,3-b...
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2,1,3-Benzoxadiazole-4-carboxaldehydeCas Number: 32863-32-4Formula: C7H4N2O2 Molecular Weight: 148.12IUPAC Name: 2,1,3-benzoxadiazole-4-carbaldehydeSMILES: C1=CC2=NON=C2C(=C1)C=OInChIKey: YBBRQAXNTWMMFZ-UHFFFAOYSA-NInChI: InChI=1S/C7H4N2O2/c10-4-5-2-1-3-6-7(5)9-11-8-6/h1-4HSynonyms: 4-Benzofurazancarboxaldehyde|32863-32-4|2,1,3-benzoxadiazole-4-carbaldehyde|benzo[c][1,2,5]oxadiazole-4-carbaldehyde|...
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4-(N,N-Dimethylaminosulfonyl)-7-amino-2,1,3-benzoxadiazoleCas Number: 147611-83-4Formula: C8H10N4O3S Molecular Weight: 242.25IUPAC Name: 7-amino-N,N-dimethyl-2,1,3-benzoxadiazole-4-sulfonamideSMILES: CN(C)S(=O)(=O)C1=CC=C(C2=NON=C12)NInChIKey: ZRHMJRAHRITJBK-UHFFFAOYSA-NInChI: InChI=1S/C8H10N4O3S/c1-12(2)16(13,14)6-4-3-5(9)7-8(6)11-15-10-7/h3-4H,9H2,1-2H3Synonyms: XFA61183 | DTXSID50659820 | AKOS027252926 | D90231 | AS-70371 | 4-(N,N-Dimethylaminosulfonyl)-7-amino-2,1,3-benzoxadi...
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(R)-(-)-NBD-Py-NCS [=(R)-(-)-4-(3-Isothiocyanatopyrrolidin-1-yl)-7-nitro-2,1,3-benzoxadiazole] [HPLC Labeling Reagent for e.e. Determination]Cas Number: 163927-29-5 Compound CID: 16218431Formula: C11H9N5O3S Molecular Weight: 291.29IUPAC Name: 7-[(3R)-3-isothiocyanatopyrrolidin-1-yl]-4-nitro-2,1,3-benzoxadiazoleSMILES: C1CN(CC1N=C=S)C2=CC=C(C3=NON=C23)[N+](=O)[O-]InChIKey: CHKCHHTYBXOUKH-SSDOTTSWSA-NInChI: InChI=1S/C11H9N5O3S/c17-16(18)9-2-1-8(10-11(9)14-19-13-10)15-4-3-7(5-15)12-6-20/h1-2,7H,3-5H2/t7-/m1/s1Synonyms: (R)-(-)-NBD-Py-NCS [=(R)-(-)-4-(3-Isothiocyanatopyrrolidin-1-yl)-7-nitro-2,1,3-benzoxadiazole] | 4-[(3R)-3-Isothiocya...
