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Benzodiazines
Description:
Aromatic heterocyclic compounds containing a benzene ring fused to a diazine ring. The diazine ring is an analogue of benzene, where two carbon atoms are replaced by nitrogen atoms.
Ancestors:
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4-Chloro-6-ethoxyquinazolineCas Number: 155960-92-2 Compound CID: 11820388Formula: C10H9ClN2O Molecular Weight: 208.64IUPAC Name: 4-chloro-6-ethoxyquinazolineSMILES: CCOC1=CC2=C(C=C1)N=CN=C2ClInChIKey: GNWPZLGHHNOKML-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClN2O/c1-2-14-7-3-4-9-8(5-7)10(11)13-6-12-9/h3-6H,2H2,1H3 -
4-Chloro-5，7-dimethoxyquinazolineCas Number: 884340-91-4 Compound CID: 22140733Formula: C10H9ClN2O2 Molecular Weight: 224.64IUPAC Name: 4-chloro-5,7-dimethoxyquinazolineSMILES: COC1=CC2=C(C(=C1)OC)C(=NC=N2)ClInChIKey: BTGIKZVZNHHDAU-UHFFFAOYSA-NInChI: InChI=1S/C10H9ClN2O2/c1-14-6-3-7-9(8(4-6)15-2)10(11)13-5-12-7/h3-5H,1-2H3
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4-Chloro-5，7-difluoroquinazolineCas Number: 791602-75-0 Compound CID: 53402600Formula: C8H3ClF2N2 Molecular Weight: 200.57IUPAC Name: 4-chloro-5,7-difluoroquinazolineSMILES: C1=C(C=C(C2=C1N=CN=C2Cl)F)FInChIKey: GYHQPNLHJJSYSN-UHFFFAOYSA-NInChI: InChI=1S/C8H3ClF2N2/c9-8-7-5(11)1-4(10)2-6(7)12-3-13-8/h1-3H
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4-Chloro-5，6，7，8-tetrahydroquinazolineCas Number: 1125-62-8 Compound CID: 12582969Formula: C8H9N2Cl Molecular Weight: 168.62IUPAC Name: 4-chloro-5,6,7,8-tetrahydroquinazolineSMILES: C1CCC2=C(C1)C(=NC=N2)ClInChIKey: AHCZEYDUHAFFKD-UHFFFAOYSA-NInChI: InChI=1S/C8H9ClN2/c9-8-6-3-1-2-4-7(6)10-5-11-8/h5H,1-4H2
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4-Benzylphthalazin-1(2H)-oneCas Number: 32003-14-8 Compound CID: 616651Formula: C15H12N2O Molecular Weight: 236.28IUPAC Name: 4-benzyl-2H-phthalazin-1-oneSMILES: C1=CC=C(C=C1)CC2=NNC(=O)C3=CC=CC=C32InChIKey: JUCCMEHWBGPJKS-UHFFFAOYSA-NInChI: InChI=1S/C15H12N2O/c18-15-13-9-5-4-8-12(13)14(16-17-15)10-11-6-2-1-3-7-11/h1-9H,10H2,(H,17,18)
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4-Amino-6-fluorocinnoline-3-carboxylic acidCas Number: 161373-43-9 Compound CID: 3074774Formula: C9H6FN3O2 Molecular Weight: 207.16IUPAC Name: 4-amino-6-fluorocinnoline-3-carboxylic acidSMILES: C1=CC2=C(C=C1F)C(=C(N=N2)C(=O)O)NInChIKey: QBUGYSNCFMFXMD-UHFFFAOYSA-NInChI: InChI=1S/C9H6FN3O2/c10-4-1-2-6-5(3-4)7(11)8(9(14)15)13-12-6/h1-3H,(H2,11,12)(H,14,15)
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4-((3-Chloro-4-fluorophenyl)amino)-7-methoxyquinazolin-6-yl acetateCas Number: 788136-89-0 Compound CID: 21098396Formula: C17H13ClFN3O3 Molecular Weight: 361.76IUPAC Name: [4-(3-chloro-4-fluoroanilino)-7-methoxyquinazolin-6-yl] acetateSMILES: CC(=O)OC1=C(C=C2C(=C1)C(=NC=N2)NC3=CC(=C(C=C3)F)Cl)OCInChIKey: ANGPUOTYQQFHKN-UHFFFAOYSA-NInChI: InChI=1S/C17H13ClFN3O3/c1-9(23)25-16-6-11-14(7-15(16)24-2)20-8-21-17(11)22-10-3-4-13(19)12(18)5-10/h3-8H,1-2H3,(H,20,21,22)
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3-Methyl-4-oxo-3，4-dihydroquinazoline-7-carboxylic acidCas Number: 1060817-67-5 Compound CID: 28065182Formula: C10H8N2O3•HCl Molecular Weight: 240.64IUPAC Name: 3-methyl-4-oxoquinazoline-7-carboxylic acidSMILES: CN1C=NC2=C(C1=O)C=CC(=C2)C(=O)OInChIKey: VXTJQVWLKUDPMD-UHFFFAOYSA-NInChI: InChI=1S/C10H8N2O3/c1-12-5-11-8-4-6(10(14)15)2-3-7(8)9(12)13/h2-5H,1H3,(H,14,15)
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3-Methyl-5-cinnolinamineCas Number: 300690-74-8 Compound CID: 5310645Formula: C9H9N3 Molecular Weight: 159.19IUPAC Name: 3-methylcinnolin-5-amineSMILES: CC1=CC2=C(C=CC=C2N=N1)NInChIKey: HOJQDQQMHMVETF-UHFFFAOYSA-NInChI: InChI=1S/C9H9N3/c1-6-5-7-8(10)3-2-4-9(7)12-11-6/h2-5H,10H2,1H3
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3-Chloroquinoxaline-2-carbaldehydeCas Number: 49568-68-5 Compound CID: 12718135Formula: C9H5ClN2O Molecular Weight: 192.6IUPAC Name: 3-chloroquinoxaline-2-carbaldehydeSMILES: C1=CC=C2C(=C1)N=C(C(=N2)Cl)C=OInChIKey: BLMMXMOMXZQXNR-UHFFFAOYSA-NInChI: InChI=1S/C9H5ClN2O/c10-9-8(5-13)11-6-3-1-2-4-7(6)12-9/h1-5H
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3-BromocinnolineCas Number: 78593-33-6 Compound CID: 12678051Formula: C8H5BrN2IUPAC Name: 3-bromocinnolineSMILES: C1=CC=C2C(=C1)C=C(N=N2)BrInChIKey: MEYRUXMLXSGXKP-UHFFFAOYSA-NInChI: InChI=1S/C8H5BrN2/c9-8-5-6-3-1-2-4-7(6)10-11-8/h1-5H
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3-(2-Chlorophenyl)-6-fluoro-2-methylquinazolin-4(3H)-oneCas Number: 49579-12-6 Compound CID: 64065Formula: C15H10ClFN2O Molecular Weight: 288.7IUPAC Name: 3-(2-chlorophenyl)-6-fluoro-2-methylquinazolin-4-oneSMILES: CC1=NC2=C(C=C(C=C2)F)C(=O)N1C3=CC=CC=C3ClInChIKey: TYDLGASFRRAUKQ-UHFFFAOYSA-NInChI: InChI=1S/C15H10ClFN2O/c1-9-18-13-7-6-10(17)8-11(13)15(20)19(9)14-5-3-2-4-12(14)16/h2-8H,1H3
