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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCSC1=C(C(CC(=O)N1)C2=CC3=C(C=C2)OCO3)C#N

Isomeric SMILES

CCCCSC1=C(C(CC(=O)N1)C2=CC3=C(C=C2)OCO3)C#N

InChI

InChI=1S/C17H18N2O3S/c1-2-3-6-23-17-13(9-18)12(8-16(20)19-17)11-4-5-14-15(7-11)22-10-21-14/h4-5,7,12H,2-3,6,8,10H2,1H3,(H,19,20)