2-[(E)-3-(dimethylamino)-3-methylsulfanyl-1-(2-propan-2-ylphenyl)prop-2-enylidene]propanedinitrile

Systemtic Name: 2-[(E)-3-(dimethylamino)-3-methylsulfanyl-1-(2-propan-2-ylphenyl)prop-2-enylidene]propanedinitrile Openeye Name: 2-[(E)-3-(dimethylamino)-1-(2-isopropylphenyl)-3-methylsulfanyl-prop-2-enylidene]propanedinitrile CAS Name: 2-[(E)-3-(dimethylamino)-3-(methylthio)-1-(2-propan-2-ylphenyl)prop-2-enylidene]propanedinitrile IUPAC Name: 2-[(E)-3-(dimethylamino)-3-methylsulfanyl-1-(2-propan-2-ylphenyl)prop-2-enylidene]propanedinitrile Traditional Name: 2-[(E)-3-(dimethylamino)-3-(methylthio)-1-o-cumenyl-prop-2-enylidene]malononitrile Formula: C18H21N3S MolecularWeight: 311.44444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=CC=C1C(=C(C#N)C#N)C=C(N(C)C)SC

Isomeric SMILES

CC(C)C1=CC=CC=C1C(=C(C#N)C#N)/C=C(\N(C)C)/SC

InChI

InChI=1S/C18H21N3S/c1-13(2)15-8-6-7-9-16(15)17(14(11-19)12-20)10-18(22-5)21(3)4/h6-10,13H,1-5H3/b18-10+