6-(cyclohexa-1,3-dien-1-ylmethylsulfanyl)-4-(4-ethoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 6-(cyclohexa-1,3-dien-1-ylmethylsulfanyl)-4-(4-ethoxyphenyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 6-(cyclohexa-1,3-dien-1-ylmethylsulfanyl)-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 6-(1-cyclohexa-1,3-dienylmethylthio)-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-(cyclohexa-1,3-dien-1-ylmethylsulfanyl)-4-(4-ethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 6-(cyclohexa-1,3-dien-1-ylmethylthio)-2-keto-4-p-phenetyl-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C21H22N2O2S MolecularWeight: 366.47658

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CCC3

Isomeric SMILES

CCOC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CCC3

InChI

InChI=1S/C21H22N2O2S/c1-2-25-17-10-8-16(9-11-17)18-12-20(24)23-21(19(18)13-22)26-14-15-6-4-3-5-7-15/h3-4,6,8-11,18H,2,5,7,12,14H2,1H3,(H,23,24)