2,4-bis(chloranyl)-N-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-ylcarbonyl)-2-methyl-phenyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-ylcarbonyl)-2-methyl-phenyl]benzamide Openeye Name: 2,4-dichloro-N-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl)-2-methyl-phenyl]benzamide CAS Name: 2,4-dichloro-N-[4-[6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepin-5-yl(oxo)methyl]-2-methylphenyl]benzamide IUPAC Name: 2,4-dichloro-N-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl)-2-methylphenyl]benzamide Traditional Name: 2,4-dichloro-N-[4-(6,11-dihydropyrrolo[2,1-c][1,4]benzodiazepine-5-carbonyl)-2-methyl-phenyl]benzamide Formula: C27H21Cl2N3O2 MolecularWeight: 490.38054

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)C(=O)N2CC3=CC=CN3CC4=CC=CC=C42)NC(=O)C5=C(C=C(C=C5)Cl)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)C(=O)N2CC3=CC=CN3CC4=CC=CC=C42)NC(=O)C5=C(C=C(C=C5)Cl)Cl

InChI

InChI=1S/C27H21Cl2N3O2/c1-17-13-18(8-11-24(17)30-26(33)22-10-9-20(28)14-23(22)29)27(34)32-16-21-6-4-12-31(21)15-19-5-2-3-7-25(19)32/h2-14H,15-16H2,1H3,(H,30,33)