[2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-methylsulfanylbenzoate

Systemtic Name: [2-oxidanylidene-2-(prop-2-ynylamino)ethyl] 2-methylsulfanylbenzoate Openeye Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-methylsulfanylbenzoate CAS Name: 2-(methylthio)benzoic acid [2-oxo-2-(prop-2-ynylamino)ethyl] ester IUPAC Name: [2-oxo-2-(prop-2-ynylamino)ethyl] 2-methylsulfanylbenzoate Traditional Name: 2-(methylthio)benzoic acid [2-keto-2-(propargylamino)ethyl] ester Formula: C13H13NO3S MolecularWeight: 263.31222

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)OCC(=O)NCC#C

Isomeric SMILES

CSC1=CC=CC=C1C(=O)OCC(=O)NCC#C

InChI

InChI=1S/C13H13NO3S/c1-3-8-14-12(15)9-17-13(16)10-6-4-5-7-11(10)18-2/h1,4-7H,8-9H2,2H3,(H,14,15)