[2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-thiophen-3-ylethanoate

Systemtic Name: [2-[[4-(cyanomethyl)phenyl]amino]-2-oxidanylidene-ethyl] 2-thiophen-3-ylethanoate Openeye Name: [2-[4-(cyanomethyl)anilino]-2-oxo-ethyl] 2-(3-thienyl)acetate CAS Name: 2-(3-thiophenyl)acetic acid [2-[4-(cyanomethyl)anilino]-2-oxoethyl] ester IUPAC Name: [2-[4-(cyanomethyl)anilino]-2-oxoethyl] 2-thiophen-3-ylacetate Traditional Name: 2-(3-thienyl)acetic acid [2-[4-(cyanomethyl)anilino]-2-keto-ethyl] ester Formula: C16H14N2O3S MolecularWeight: 314.35896

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC#N)NC(=O)COC(=O)CC2=CSC=C2

Isomeric SMILES

C1=CC(=CC=C1CC#N)NC(=O)COC(=O)CC2=CSC=C2

InChI

InChI=1S/C16H14N2O3S/c17-7-5-12-1-3-14(4-2-12)18-15(19)10-21-16(20)9-13-6-8-22-11-13/h1-4,6,8,11H,5,9-10H2,(H,18,19)