[2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)benzoate

Systemtic Name: [2-[(4-cyanophenyl)amino]-2-oxidanylidene-ethyl] 3-(thiophen-2-ylcarbonylamino)benzoate Openeye Name: [2-(4-cyanoanilino)-2-oxo-ethyl] 3-(thiophene-2-carbonylamino)benzoate CAS Name: 3-[[oxo(thiophen-2-yl)methyl]amino]benzoic acid [2-(4-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-cyanoanilino)-2-oxoethyl] 3-(thiophene-2-carbonylamino)benzoate Traditional Name: 3-(2-thenoylamino)benzoic acid [2-(4-cyanoanilino)-2-keto-ethyl] ester Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)OCC(=O)NC3=CC=C(C=C3)C#N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)C2=CC=CS2)C(=O)OCC(=O)NC3=CC=C(C=C3)C#N

InChI

InChI=1S/C21H15N3O4S/c22-12-14-6-8-16(9-7-14)23-19(25)13-28-21(27)15-3-1-4-17(11-15)24-20(26)18-5-2-10-29-18/h1-11H,13H2,(H,23,25)(H,24,26)