N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-(phenylsulfonylamino)cyclohexane-1-carboxamide

Systemtic Name: N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-(phenylsulfonylamino)cyclohexane-1-carboxamide Openeye Name: 1-(benzenesulfonamido)-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide CAS Name: 1-(benzenesulfonamido)-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-cyclohexanecarboxamide IUPAC Name: 1-(benzenesulfonamido)-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide Traditional Name: 1-(benzenesulfonamido)-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Formula: C29H30N4O4S MolecularWeight: 530.6379

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3(CCCCC3)NS(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CN1C2=CC=CC=C2C(=NC(C1=O)NC(=O)C3(CCCCC3)NS(=O)(=O)C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C29H30N4O4S/c1-33-24-18-10-9-17-23(24)25(21-13-5-2-6-14-21)30-26(27(33)34)31-28(35)29(19-11-4-12-20-29)32-38(36,37)22-15-7-3-8-16-22/h2-3,5-10,13-18,26,32H,4,11-12,19-20H2,1H3,(H,31,35)