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

Systemtic Name: ethyl 2-methyl-5-oxidanylidene-4-[2-(phenylmethylsulfanyl)phenyl]-7H-furo[3,4-b]pyridine-3-carboxylate Openeye Name: ethyl 4-(2-benzylsulfanylphenyl)-2-methyl-5-oxo-7H-furo[3,4-b]pyridine-3-carboxylate CAS Name: 2-methyl-5-oxo-4-[2-(phenylmethylthio)phenyl]-7H-furo[3,4-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 4-(2-benzylsulfanylphenyl)-2-methyl-5-oxo-7H-furo[3,4-b]pyridine-3-carboxylate Traditional Name: 4-[2-(benzylthio)phenyl]-5-keto-2-methyl-7H-furo[3,4-b]pyridine-3-carboxylic acid ethyl ester Formula: C24H21NO4S MolecularWeight: 419.49284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N=C2COC(=O)C2=C1C3=CC=CC=C3SCC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=C(N=C2COC(=O)C2=C1C3=CC=CC=C3SCC4=CC=CC=C4)C

InChI

InChI=1S/C24H21NO4S/c1-3-28-23(26)20-15(2)25-18-13-29-24(27)22(18)21(20)17-11-7-8-12-19(17)30-14-16-9-5-4-6-10-16/h4-12H,3,13-14H2,1-2H3