4-(1,3-benzodioxol-5-yl)-6-(2-methylpropylsulfanyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile

Systemtic Name: 4-(1,3-benzodioxol-5-yl)-6-(2-methylpropylsulfanyl)-2-oxidanylidene-3,4-dihydro-1H-pyridine-5-carbonitrile Openeye Name: 4-(1,3-benzodioxol-5-yl)-6-isobutylsulfanyl-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile CAS Name: 4-(1,3-benzodioxol-5-yl)-6-(2-methylpropylthio)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile IUPAC Name: 4-(1,3-benzodioxol-5-yl)-6-(2-methylpropylsulfanyl)-2-oxo-3,4-dihydro-1H-pyridine-5-carbonitrile Traditional Name: 4-(1,3-benzodioxol-5-yl)-6-(isobutylthio)-2-keto-3,4-dihydro-1H-pyridine-5-carbonitrile Formula: C17H18N2O3S MolecularWeight: 330.40142

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=C(C(CC(=O)N1)C2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

CC(C)CSC1=C(C(CC(=O)N1)C2=CC3=C(C=C2)OCO3)C#N

InChI

InChI=1S/C17H18N2O3S/c1-10(2)8-23-17-13(7-18)12(6-16(20)19-17)11-3-4-14-15(5-11)22-9-21-14/h3-5,10,12H,6,8-9H2,1-2H3,(H,19,20)