4-(4-ethylphenyl)-2-oxidanylidene-6-(phenylmethylsulfanyl)-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 4-(4-ethylphenyl)-2-oxidanylidene-6-(phenylmethylsulfanyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 6-benzylsulfanyl-4-(4-ethylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-ethylphenyl)-2-oxo-6-(phenylmethylthio)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-benzylsulfanyl-4-(4-ethylphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 6-(benzylthio)-4-(4-ethylphenyl)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C21H20N2OS MolecularWeight: 348.4613

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CC=C3

InChI

InChI=1S/C21H20N2OS/c1-2-15-8-10-17(11-9-15)18-12-20(24)23-21(19(18)13-22)25-14-16-6-4-3-5-7-16/h3-11,18H,2,12,14H2,1H3,(H,23,24)