[2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] thiophene-2-carboxylate

Systemtic Name: [2-oxidanylidene-2-(3-phenylsulfanylpropylamino)ethyl] thiophene-2-carboxylate Openeye Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [2-oxo-2-[3-(phenylthio)propylamino]ethyl] ester IUPAC Name: [2-oxo-2-(3-phenylsulfanylpropylamino)ethyl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [2-keto-2-[3-(phenylthio)propylamino]ethyl] ester Formula: C16H17NO3S2 MolecularWeight: 335.44108

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)C2=CC=CS2

Isomeric SMILES

C1=CC=C(C=C1)SCCCNC(=O)COC(=O)C2=CC=CS2

InChI

InChI=1S/C16H17NO3S2/c18-15(12-20-16(19)14-8-4-10-22-14)17-9-5-11-21-13-6-2-1-3-7-13/h1-4,6-8,10H,5,9,11-12H2,(H,17,18)