methyl 2-methyl-5-oxidanylidene-4-[2-(phenylmethylsulfanyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate

Systemtic Name: methyl 2-methyl-5-oxidanylidene-4-[2-(phenylmethylsulfanyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Openeye Name: methyl 4-(2-benzylsulfanylphenyl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate CAS Name: 2-methyl-5-oxo-4-[2-(phenylmethylthio)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid methyl ester IUPAC Name: methyl 4-(2-benzylsulfanylphenyl)-2-methyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Traditional Name: 4-[2-(benzylthio)phenyl]-5-keto-2-methyl-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid methyl ester Formula: C23H21NO4S MolecularWeight: 407.48214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C2=C(N1)COC2=O)C3=CC=CC=C3SCC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CC1=C(C(C2=C(N1)COC2=O)C3=CC=CC=C3SCC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C23H21NO4S/c1-14-19(22(25)27-2)20(21-17(24-14)12-28-23(21)26)16-10-6-7-11-18(16)29-13-15-8-4-3-5-9-15/h3-11,20,24H,12-13H2,1-2H3