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

Systemtic Name: 2-[(E)-3-methylsulfanyl-1-phenyl-3-pyrrolidin-1-yl-prop-2-enylidene]propanedinitrile Openeye Name: 2-[(E)-3-methylsulfanyl-1-phenyl-3-pyrrolidin-1-yl-prop-2-enylidene]propanedinitrile CAS Name: 2-[(E)-3-(methylthio)-1-phenyl-3-(1-pyrrolidinyl)prop-2-enylidene]propanedinitrile IUPAC Name: 2-[(E)-3-methylsulfanyl-1-phenyl-3-pyrrolidin-1-ylprop-2-enylidene]propanedinitrile Traditional Name: 2-[(E)-3-(methylthio)-1-phenyl-3-pyrrolidino-prop-2-enylidene]malononitrile Formula: C17H17N3S MolecularWeight: 295.40198

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Descriptors Computed from Structure

Canonical SMILES:

CSC(=CC(=C(C#N)C#N)C1=CC=CC=C1)N2CCCC2

Isomeric SMILES

CS/C(=C/C(=C(C#N)C#N)C1=CC=CC=C1)/N2CCCC2

InChI

InChI=1S/C17H17N3S/c1-21-17(20-9-5-6-10-20)11-16(15(12-18)13-19)14-7-3-2-4-8-14/h2-4,7-8,11H,5-6,9-10H2,1H3/b17-11+