[2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate

Systemtic Name: [2-[(3-aminocarbonylthiophen-2-yl)amino]-2-oxidanylidene-ethyl] 4-cyanobenzoate Openeye Name: [2-[(3-carbamoyl-2-thienyl)amino]-2-oxo-ethyl] 4-cyanobenzoate CAS Name: 4-cyanobenzoic acid [2-[(3-carbamoyl-2-thiophenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(3-carbamoylthiophen-2-yl)amino]-2-oxoethyl] 4-cyanobenzoate Traditional Name: 4-cyanobenzoic acid [2-[(3-carbamoyl-2-thienyl)amino]-2-keto-ethyl] ester Formula: C15H11N3O4S MolecularWeight: 329.33054

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

Isomeric SMILES

C1=CC(=CC=C1C#N)C(=O)OCC(=O)NC2=C(C=CS2)C(=O)N

InChI

InChI=1S/C15H11N3O4S/c16-7-9-1-3-10(4-2-9)15(21)22-8-12(19)18-14-11(13(17)20)5-6-23-14/h1-6H,8H2,(H2,17,20)(H,18,19)