4-[[2-[(4-cyanophenyl)amino]-5-methyl-pyrimidin-4-yl]amino]-3,5-dimethyl-benzenecarbonitrile

Systemtic Name: 4-[[2-[(4-cyanophenyl)amino]-5-methyl-pyrimidin-4-yl]amino]-3,5-dimethyl-benzenecarbonitrile Openeye Name: 4-[[2-(4-cyanoanilino)-5-methyl-pyrimidin-4-yl]amino]-3,5-dimethyl-benzonitrile CAS Name: 4-[[2-(4-cyanoanilino)-5-methyl-4-pyrimidinyl]amino]-3,5-dimethylbenzonitrile IUPAC Name: 4-[[2-(4-cyanoanilino)-5-methylpyrimidin-4-yl]amino]-3,5-dimethylbenzonitrile Traditional Name: 4-[[2-(4-cyanoanilino)-5-methyl-pyrimidin-4-yl]amino]-3,5-dimethyl-benzonitrile Formula: C21H18N6 MolecularWeight: 354.40782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC(=NC=C2C)NC3=CC=C(C=C3)C#N)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC(=NC=C2C)NC3=CC=C(C=C3)C#N)C)C#N

InChI

InChI=1S/C21H18N6/c1-13-8-17(11-23)9-14(2)19(13)26-20-15(3)12-24-21(27-20)25-18-6-4-16(10-22)5-7-18/h4-9,12H,1-3H3,(H2,24,25,26,27)