2-[(4-bromophenyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide

Systemtic Name: 2-[(4-bromophenyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxidanylidene-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide Openeye Name: 2-[(4-bromophenyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide CAS Name: 2-[(4-bromophenyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide IUPAC Name: 2-[(4-bromophenyl)sulfonylamino]-4-methyl-N-(1-methyl-2-oxo-5-phenyl-3H-1,4-benzodiazepin-3-yl)pentanamide Traditional Name: 2-(brosylamino)-N-(2-keto-1-methyl-5-phenyl-3H-1,4-benzodiazepin-3-yl)-4-methyl-valeramide Formula: C28H29BrN4O4S MolecularWeight: 597.52326

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)Br

Isomeric SMILES

CC(C)CC(C(=O)NC1C(=O)N(C2=CC=CC=C2C(=N1)C3=CC=CC=C3)C)NS(=O)(=O)C4=CC=C(C=C4)Br

InChI

InChI=1S/C28H29BrN4O4S/c1-18(2)17-23(32-38(36,37)21-15-13-20(29)14-16-21)27(34)31-26-28(35)33(3)24-12-8-7-11-22(24)25(30-26)19-9-5-4-6-10-19/h4-16,18,23,26,32H,17H2,1-3H3,(H,31,34)