[2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-methylphenyl)sulfanylethanoate

Systemtic Name: [2-(furan-2-ylmethylamino)-2-oxidanylidene-ethyl] 2-(2-methylphenyl)sulfanylethanoate Openeye Name: [2-(2-furylmethylamino)-2-oxo-ethyl] 2-(o-tolylsulfanyl)acetate CAS Name: 2-[(2-methylphenyl)thio]acetic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester IUPAC Name: [2-(furan-2-ylmethylamino)-2-oxoethyl] 2-(2-methylphenyl)sulfanylacetate Traditional Name: 2-(o-tolylthio)acetic acid [2-(2-furfurylamino)-2-keto-ethyl] ester Formula: C16H17NO4S MolecularWeight: 319.37548

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1SCC(=O)OCC(=O)NCC2=CC=CO2

Isomeric SMILES

CC1=CC=CC=C1SCC(=O)OCC(=O)NCC2=CC=CO2

InChI

InChI=1S/C16H17NO4S/c1-12-5-2-3-7-14(12)22-11-16(19)21-10-15(18)17-9-13-6-4-8-20-13/h2-8H,9-11H2,1H3,(H,17,18)