6-methylsulfanyl-2-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 6-methylsulfanyl-2-oxidanylidene-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-benzyloxyphenyl)-6-methylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 6-(methylthio)-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-methylsulfanyl-2-oxo-4-(4-phenylmethoxyphenyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-benzoxyphenyl)-2-keto-6-(methylthio)-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C20H18N2O2S MolecularWeight: 350.43412

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C#N

Isomeric SMILES

CSC1=C(C(CC(=O)N1)C2=CC=C(C=C2)OCC3=CC=CC=C3)C#N

InChI

InChI=1S/C20H18N2O2S/c1-25-20-18(12-21)17(11-19(23)22-20)15-7-9-16(10-8-15)24-13-14-5-3-2-4-6-14/h2-10,17H,11,13H2,1H3,(H,22,23)