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

Systemtic Name: methyl 2-ethyl-5-oxidanylidene-4-[2-(phenylmethylsulfanyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Openeye Name: methyl 4-(2-benzylsulfanylphenyl)-2-ethyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate CAS Name: 2-ethyl-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-ethyl-5-oxo-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Traditional Name: 4-[2-(benzylthio)phenyl]-2-ethyl-5-keto-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid methyl ester Formula: C24H23NO4S MolecularWeight: 421.50872

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(C2=C(N1)COC2=O)C3=CC=CC=C3SCC4=CC=CC=C4)C(=O)OC

Isomeric SMILES

CCC1=C(C(C2=C(N1)COC2=O)C3=CC=CC=C3SCC4=CC=CC=C4)C(=O)OC

InChI

InChI=1S/C24H23NO4S/c1-3-17-21(23(26)28-2)20(22-18(25-17)13-29-24(22)27)16-11-7-8-12-19(16)30-14-15-9-5-4-6-10-15/h4-12,20,25H,3,13-14H2,1-2H3