ethyl 2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate

Systemtic Name: ethyl 2-[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoate Openeye Name: ethyl 2-[2-(3-cyanoanilino)-2-oxo-ethyl]sulfanylacetate CAS Name: 2-[[2-(3-cyanoanilino)-2-oxoethyl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-(3-cyanoanilino)-2-oxoethyl]sulfanylacetate Traditional Name: 2-[[2-(3-cyanoanilino)-2-keto-ethyl]thio]acetic acid ethyl ester Formula: C13H14N2O3S MolecularWeight: 278.32686

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSCC(=O)NC1=CC=CC(=C1)C#N

Isomeric SMILES

CCOC(=O)CSCC(=O)NC1=CC=CC(=C1)C#N

InChI

InChI=1S/C13H14N2O3S/c1-2-18-13(17)9-19-8-12(16)15-11-5-3-4-10(6-11)7-14/h3-6H,2,8-9H2,1H3,(H,15,16)