[2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methylbenzoate

Systemtic Name: [2-oxidanylidene-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methylbenzoate Openeye Name: [2-oxo-2-[2-(2-thienylmethylsulfanyl)ethylamino]ethyl] 4-methylbenzoate CAS Name: 4-methylbenzoic acid [2-oxo-2-[2-(thiophen-2-ylmethylthio)ethylamino]ethyl] ester IUPAC Name: [2-oxo-2-[2-(thiophen-2-ylmethylsulfanyl)ethylamino]ethyl] 4-methylbenzoate Traditional Name: 4-methylbenzoic acid [2-keto-2-[2-(2-thenylthio)ethylamino]ethyl] ester Formula: C17H19NO3S2 MolecularWeight: 349.46766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)OCC(=O)NCCSCC2=CC=CS2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)OCC(=O)NCCSCC2=CC=CS2

InChI

InChI=1S/C17H19NO3S2/c1-13-4-6-14(7-5-13)17(20)21-11-16(19)18-8-10-22-12-15-3-2-9-23-15/h2-7,9H,8,10-12H2,1H3,(H,18,19)