methyl 2-[[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]carbonyloxymethyl]furan-3-carboxylate

Systemtic Name: methyl 2-[[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylphenyl]carbonyloxymethyl]furan-3-carboxylate Openeye Name: methyl 2-[[2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylbenzoyl]oxymethyl]furan-3-carboxylate CAS Name: 2-[[[2-[[2-(4-methylanilino)-2-oxoethyl]thio]phenyl]-oxomethoxy]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 2-[[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylbenzoyl]oxymethyl]furan-3-carboxylate Traditional Name: 2-[[2-[[2-keto-2-(p-toluidino)ethyl]thio]benzoyl]oxymethyl]furan-3-carboxylic acid methyl ester Formula: C23H21NO6S MolecularWeight: 439.48094

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)OCC3=C(C=CO3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSC2=CC=CC=C2C(=O)OCC3=C(C=CO3)C(=O)OC

InChI

InChI=1S/C23H21NO6S/c1-15-7-9-16(10-8-15)24-21(25)14-31-20-6-4-3-5-18(20)23(27)30-13-19-17(11-12-29-19)22(26)28-2/h3-12H,13-14H2,1-2H3,(H,24,25)