5-[(5-cyclohexyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-(2-methylphenyl)sulfonyl-benzamide

Systemtic Name: 5-[(5-cyclohexyl-1-methyl-2-oxidanylidene-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-(2-methylphenyl)sulfonyl-benzamide Openeye Name: 5-[(5-cyclohexyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-(o-tolylsulfonyl)benzamide CAS Name: 5-[[[(5-cyclohexyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)amino]-oxomethyl]amino]-2-methyl-N-(2-methylphenyl)sulfonylbenzamide IUPAC Name: 5-[(5-cyclohexyl-1-methyl-2-oxo-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-(2-methylphenyl)sulfonylbenzamide Traditional Name: 5-[(5-cyclohexyl-2-keto-1-methyl-3H-1,4-benzodiazepin-3-yl)carbamoylamino]-2-methyl-N-(o-tolylsulfonyl)benzamide Formula: C32H35N5O5S MolecularWeight: 601.7158

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4CCCCC4)C)C(=O)NS(=O)(=O)C5=CC=CC=C5C

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NC2C(=O)N(C3=CC=CC=C3C(=N2)C4CCCCC4)C)C(=O)NS(=O)(=O)C5=CC=CC=C5C

InChI

InChI=1S/C32H35N5O5S/c1-20-17-18-23(19-25(20)30(38)36-43(41,42)27-16-10-7-11-21(27)2)33-32(40)35-29-31(39)37(3)26-15-9-8-14-24(26)28(34-29)22-12-5-4-6-13-22/h7-11,14-19,22,29H,4-6,12-13H2,1-3H3,(H,36,38)(H2,33,35,40)