2-[(E)-1-(2-methoxyphenyl)-3-[methyl-(phenylmethyl)amino]-3-methylsulfanyl-prop-2-enylidene]propanedinitrile

Systemtic Name: 2-[(E)-1-(2-methoxyphenyl)-3-[methyl-(phenylmethyl)amino]-3-methylsulfanyl-prop-2-enylidene]propanedinitrile Openeye Name: 2-[(E)-3-[benzyl(methyl)amino]-1-(2-methoxyphenyl)-3-methylsulfanyl-prop-2-enylidene]propanedinitrile CAS Name: 2-[(E)-1-(2-methoxyphenyl)-3-[methyl-(phenylmethyl)amino]-3-(methylthio)prop-2-enylidene]propanedinitrile IUPAC Name: 2-[(E)-3-[benzyl(methyl)amino]-1-(2-methoxyphenyl)-3-methylsulfanylprop-2-enylidene]propanedinitrile Traditional Name: 2-[(E)-3-[benzyl(methyl)amino]-1-(2-methoxyphenyl)-3-(methylthio)prop-2-enylidene]malononitrile Formula: C22H21N3OS MolecularWeight: 375.48664

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)C(=CC(=C(C#N)C#N)C2=CC=CC=C2OC)SC

Isomeric SMILES

CN(CC1=CC=CC=C1)/C(=C\C(=C(C#N)C#N)C2=CC=CC=C2OC)/SC

InChI

InChI=1S/C22H21N3OS/c1-25(16-17-9-5-4-6-10-17)22(27-3)13-20(18(14-23)15-24)19-11-7-8-12-21(19)26-2/h4-13H,16H2,1-3H3/b22-13+