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

Systemtic Name: 4-(4-methoxy-3-phenylmethoxy-phenyl)-2-oxidanylidene-6-(phenylmethylsulfanyl)-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(3-benzyloxy-4-methoxy-phenyl)-6-benzylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxo-6-(phenylmethylthio)-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 6-benzylsulfanyl-4-(4-methoxy-3-phenylmethoxyphenyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(3-benzoxy-4-methoxy-phenyl)-6-(benzylthio)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C27H24N2O3S MolecularWeight: 456.55606

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CC=C3)OCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)NC(=C2C#N)SCC3=CC=CC=C3)OCC4=CC=CC=C4

InChI

InChI=1S/C27H24N2O3S/c1-31-24-13-12-21(14-25(24)32-17-19-8-4-2-5-9-19)22-15-26(30)29-27(23(22)16-28)33-18-20-10-6-3-7-11-20/h2-14,22H,15,17-18H2,1H3,(H,29,30)