2-[[3-methyl-1-(4-methylphenyl)-5-[(phenylmethyl)amino]pyrazol-4-yl]methylidene]propanedinitrile

Systemtic Name: 2-[[3-methyl-1-(4-methylphenyl)-5-[(phenylmethyl)amino]pyrazol-4-yl]methylidene]propanedinitrile Openeye Name: 2-[[5-(benzylamino)-3-methyl-1-(p-tolyl)pyrazol-4-yl]methylene]propanedinitrile CAS Name: 2-[[3-methyl-1-(4-methylphenyl)-5-[(phenylmethyl)amino]-4-pyrazolyl]methylidene]propanedinitrile IUPAC Name: 2-[[5-(benzylamino)-3-methyl-1-(4-methylphenyl)pyrazol-4-yl]methylidene]propanedinitrile Traditional Name: 2-[[5-(benzylamino)-3-methyl-1-(p-tolyl)pyrazol-4-yl]methylene]malononitrile Formula: C22H19N5 MolecularWeight: 353.41976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C=C(C#N)C#N)NCC3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=C(C(=N2)C)C=C(C#N)C#N)NCC3=CC=CC=C3

InChI

InChI=1S/C22H19N5/c1-16-8-10-20(11-9-16)27-22(25-15-18-6-4-3-5-7-18)21(17(2)26-27)12-19(13-23)14-24/h3-12,25H,15H2,1-2H3