2-(2-cyanophenyl)sulfanyl-N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 2-(2-cyanophenyl)sulfanyl-N-[2-[(3,4-diethoxyphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 2-(2-cyanophenyl)sulfanyl-N-[2-(3,4-diethoxyanilino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 2-[(2-cyanophenyl)thio]-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 2-(2-cyanophenyl)sulfanyl-N-[2-(3,4-diethoxyanilino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 2-[(2-cyanophenyl)thio]-N-[2-(3,4-diethoxyanilino)-2-keto-ethyl]-N-methyl-benzamide Formula: C27H27N3O4S MolecularWeight: 489.58598

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)OCC

Isomeric SMILES

CCOC1=C(C=C(C=C1)NC(=O)CN(C)C(=O)C2=CC=CC=C2SC3=CC=CC=C3C#N)OCC

InChI

InChI=1S/C27H27N3O4S/c1-4-33-22-15-14-20(16-23(22)34-5-2)29-26(31)18-30(3)27(32)21-11-7-9-13-25(21)35-24-12-8-6-10-19(24)17-28/h6-16H,4-5,18H2,1-3H3,(H,29,31)