4-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanylidene-6-prop-1-en-2-ylsulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 4-(3-methoxy-4-oxidanyl-phenyl)-2-oxidanylidene-6-prop-1-en-2-ylsulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(4-hydroxy-3-methoxy-phenyl)-6-isopropenylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(4-hydroxy-3-methoxyphenyl)-6-(1-methylethenylthio)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(4-hydroxy-3-methoxyphenyl)-2-oxo-6-prop-1-en-2-ylsulfanyl-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(4-hydroxy-3-methoxy-phenyl)-6-(isopropenylthio)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C16H16N2O3S MolecularWeight: 316.37484

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)SC1=C(C(CC(=O)N1)C2=CC(=C(C=C2)O)OC)C#N

Isomeric SMILES

CC(=C)SC1=C(C(CC(=O)N1)C2=CC(=C(C=C2)O)OC)C#N

InChI

InChI=1S/C16H16N2O3S/c1-9(2)22-16-12(8-17)11(7-15(20)18-16)10-4-5-13(19)14(6-10)21-3/h4-6,11,19H,1,7H2,2-3H3,(H,18,20)