[2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-benzamido-2-phenyl-ethanoate

Systemtic Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxidanylidene-ethyl] 2-benzamido-2-phenyl-ethanoate Openeye Name: [2-[(3-cyano-2-thienyl)amino]-2-oxo-ethyl] 2-benzamido-2-phenyl-acetate CAS Name: 2-benzamido-2-phenylacetic acid [2-[(3-cyano-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-cyanothiophen-2-yl)amino]-2-oxoethyl] 2-benzamido-2-phenylacetate Traditional Name: 2-benzamido-2-phenyl-acetic acid [2-[(3-cyano-2-thienyl)amino]-2-keto-ethyl] ester Formula: C22H17N3O4S MolecularWeight: 419.45308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C(=O)OCC(=O)NC2=C(C=CS2)C#N)NC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)C(C(=O)OCC(=O)NC2=C(C=CS2)C#N)NC(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H17N3O4S/c23-13-17-11-12-30-21(17)24-18(26)14-29-22(28)19(15-7-3-1-4-8-15)25-20(27)16-9-5-2-6-10-16/h1-12,19H,14H2,(H,24,26)(H,25,27)