1-[(2,5-dimethoxyphenyl)sulfonylamino]-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide

Systemtic Name: 1-[(2,5-dimethoxyphenyl)sulfonylamino]-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide Openeye Name: 1-[(2,5-dimethoxyphenyl)sulfonylamino]-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide CAS Name: 1-[(2,5-dimethoxyphenyl)sulfonylamino]-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-cyclohexanecarboxamide IUPAC Name: 1-[(2,5-dimethoxyphenyl)sulfonylamino]-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide Traditional Name: 1-[(2,5-dimethoxyphenyl)sulfonylamino]-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Formula: C31H34N4O6S MolecularWeight: 590.68986

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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=C(C=CC(=C4)OC)OC)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C31H34N4O6S/c1-35-24-15-9-8-14-23(24)27(21-12-6-4-7-13-21)32-28(29(35)36)33-30(37)31(18-10-5-11-19-31)34-42(38,39)26-20-22(40-2)16-17-25(26)41-3/h4,6-9,12-17,20,28,34H,5,10-11,18-19H2,1-3H3,(H,33,37)