methyl 2-methyl-5-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanylmethyl]furan-3-carboxylate

Systemtic Name: methyl 2-methyl-5-[[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl]sulfanylmethyl]furan-3-carboxylate Openeye Name: methyl 5-[[2-(benzylamino)-2-oxo-ethyl]sulfanylmethyl]-2-methyl-furan-3-carboxylate CAS Name: 2-methyl-5-[[[2-oxo-2-[(phenylmethyl)amino]ethyl]thio]methyl]-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[2-(benzylamino)-2-oxoethyl]sulfanylmethyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[[2-(benzylamino)-2-keto-ethyl]thio]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C17H19NO4S MolecularWeight: 333.40206

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CSCC(=O)NCC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CSCC(=O)NCC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C17H19NO4S/c1-12-15(17(20)21-2)8-14(22-12)10-23-11-16(19)18-9-13-6-4-3-5-7-13/h3-8H,9-11H2,1-2H3,(H,18,19)