2-[(E)-3-methylsulfanyl-1-phenyl-3-piperidin-1-yl-prop-2-enylidene]propanedinitrile

Systemtic Name: 2-[(E)-3-methylsulfanyl-1-phenyl-3-piperidin-1-yl-prop-2-enylidene]propanedinitrile Openeye Name: 2-[(E)-3-methylsulfanyl-1-phenyl-3-(1-piperidyl)prop-2-enylidene]propanedinitrile CAS Name: 2-[(E)-3-(methylthio)-1-phenyl-3-(1-piperidinyl)prop-2-enylidene]propanedinitrile IUPAC Name: 2-[(E)-3-methylsulfanyl-1-phenyl-3-piperidin-1-ylprop-2-enylidene]propanedinitrile Traditional Name: 2-[(E)-3-(methylthio)-1-phenyl-3-piperidino-prop-2-enylidene]malononitrile Formula: C18H19N3S MolecularWeight: 309.42856

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC(=C(C#N)C#N)C1=CC=CC=C1)N2CCCCC2

Isomeric SMILES

CS/C(=C/C(=C(C#N)C#N)C1=CC=CC=C1)/N2CCCCC2

InChI

InChI=1S/C18H19N3S/c1-22-18(21-10-6-3-7-11-21)12-17(16(13-19)14-20)15-8-4-2-5-9-15/h2,4-5,8-9,12H,3,6-7,10-11H2,1H3/b18-12+