2-[2-(1-benzothiophen-2-yl)ethanoylamino]-N-(1-methyl-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-2-phenyl-ethanamide

Systemtic Name: 2-[2-(1-benzothiophen-2-yl)ethanoylamino]-N-(1-methyl-2-oxidanylidene-5-phenyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-2-phenyl-ethanamide Openeye Name: 2-[[2-(benzothiophen-2-yl)acetyl]amino]-N-(1-methyl-2-oxo-5-phenyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-2-phenyl-acetamide CAS Name: 2-[[2-(1-benzothiophen-2-yl)-1-oxoethyl]amino]-N-(1-methyl-2-oxo-5-phenyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-2-phenylacetamide IUPAC Name: 2-[[2-(1-benzothiophen-2-yl)acetyl]amino]-N-(1-methyl-2-oxo-5-phenyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-2-phenylacetamide Traditional Name: 2-[[2-(benzothiophen-2-yl)acetyl]amino]-N-(2-keto-1-methyl-5-phenyl-4,5-dihydro-3H-1,4-benzodiazepin-3-yl)-2-phenyl-acetamide Formula: C34H30N4O3S MolecularWeight: 574.692

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2C(NC(C1=O)NC(=O)C(C3=CC=CC=C3)NC(=O)CC4=CC5=CC=CC=C5S4)C6=CC=CC=C6

Isomeric SMILES

CN1C2=CC=CC=C2C(NC(C1=O)NC(=O)C(C3=CC=CC=C3)NC(=O)CC4=CC5=CC=CC=C5S4)C6=CC=CC=C6

InChI

InChI=1S/C34H30N4O3S/c1-38-27-18-10-9-17-26(27)30(22-12-4-2-5-13-22)36-32(34(38)41)37-33(40)31(23-14-6-3-7-15-23)35-29(39)21-25-20-24-16-8-11-19-28(24)42-25/h2-20,30-32,36H,21H2,1H3,(H,35,39)(H,37,40)