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

Systemtic Name: ethyl 2-methyl-5-oxidanylidene-4-[2-(1-phenylethylsulfanyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Openeye Name: ethyl 2-methyl-5-oxo-4-[2-(1-phenylethylsulfanyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate CAS Name: 2-methyl-5-oxo-4-[2-(1-phenylethylthio)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-methyl-5-oxo-4-[2-(1-phenylethylsulfanyl)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylate Traditional Name: 5-keto-2-methyl-4-[2-(1-phenylethylthio)phenyl]-4,7-dihydro-1H-furo[3,4-b]pyridine-3-carboxylic acid ethyl ester Formula: C25H25NO4S MolecularWeight: 435.5353

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3SC(C)C4=CC=CC=C4)C(=O)OC2)C

Isomeric SMILES

CCOC(=O)C1=C(NC2=C(C1C3=CC=CC=C3SC(C)C4=CC=CC=C4)C(=O)OC2)C

InChI

InChI=1S/C25H25NO4S/c1-4-29-24(27)21-15(2)26-19-14-30-25(28)23(19)22(21)18-12-8-9-13-20(18)31-16(3)17-10-6-5-7-11-17/h5-13,16,22,26H,4,14H2,1-3H3