O-ethyl 3-[methyl(phenyl)amino]-3-oxidanylidene-propanethioate

Systemtic Name: O-ethyl 3-[methyl(phenyl)amino]-3-oxidanylidene-propanethioate Openeye Name: O-ethyl 3-(N-methylanilino)-3-oxo-propanethioate CAS Name: 3-(N-methylanilino)-3-oxopropanethioic acid O-ethyl ester IUPAC Name: O-ethyl 3-(N-methylanilino)-3-oxopropanethioate Traditional Name: 3-keto-3-(N-methylanilino)propanethioic acid O-ethyl ester Formula: C12H15NO2S MolecularWeight: 237.318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=S)CC(=O)N(C)C1=CC=CC=C1

Isomeric SMILES

CCOC(=S)CC(=O)N(C)C1=CC=CC=C1

InChI

InChI=1S/C12H15NO2S/c1-3-15-12(16)9-11(14)13(2)10-7-5-4-6-8-10/h4-8H,3,9H2,1-2H3