[2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2,5-dimethylthiophene-3-carboxylate

Systemtic Name: [2-oxidanylidene-2-(2-phenylsulfanylethylamino)ethyl] 2,5-dimethylthiophene-3-carboxylate Openeye Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2,5-dimethylthiophene-3-carboxylate CAS Name: 2,5-dimethyl-3-thiophenecarboxylic acid [2-oxo-2-[2-(phenylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-(2-phenylsulfanylethylamino)ethyl] 2,5-dimethylthiophene-3-carboxylate Traditional Name: 2,5-dimethylthiophene-3-carboxylic acid [2-keto-2-[2-(phenylthio)ethylamino]ethyl] ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C(=O)OCC(=O)NCCSC2=CC=CC=C2

Isomeric SMILES

CC1=CC(=C(S1)C)C(=O)OCC(=O)NCCSC2=CC=CC=C2

InChI

InChI=1S/C17H19NO3S2/c1-12-10-15(13(2)23-12)17(20)21-11-16(19)18-8-9-22-14-6-4-3-5-7-14/h3-7,10H,8-9,11H2,1-2H3,(H,18,19)