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

Systemtic Name: 1-[(4-fluorophenyl)sulfonylamino]-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide Openeye Name: 1-[(4-fluorophenyl)sulfonylamino]-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide CAS Name: 1-[(4-fluorophenyl)sulfonylamino]-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)-1-cyclohexanecarboxamide IUPAC Name: 1-[(4-fluorophenyl)sulfonylamino]-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexane-1-carboxamide Traditional Name: 1-[(4-fluorophenyl)sulfonylamino]-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)cyclohexanecarboxamide Formula: C29H29FN4O4S MolecularWeight: 548.628363

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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=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

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

InChI

InChI=1S/C29H29FN4O4S/c1-34-24-13-7-6-12-23(24)25(20-10-4-2-5-11-20)31-26(27(34)35)32-28(36)29(18-8-3-9-19-29)33-39(37,38)22-16-14-21(30)15-17-22/h2,4-7,10-17,26,33H,3,8-9,18-19H2,1H3,(H,32,36)