4-[[2-(2-azanyl-3-cyano-phenyl)pyrimidin-4-yl]amino]-3,5-dimethyl-benzenecarbonitrile

Systemtic Name: 4-[[2-(2-azanyl-3-cyano-phenyl)pyrimidin-4-yl]amino]-3,5-dimethyl-benzenecarbonitrile Openeye Name: 4-[[2-(2-amino-3-cyano-phenyl)pyrimidin-4-yl]amino]-3,5-dimethyl-benzonitrile CAS Name: 4-[[2-(2-amino-3-cyanophenyl)-4-pyrimidinyl]amino]-3,5-dimethylbenzonitrile IUPAC Name: 4-[[2-(2-amino-3-cyanophenyl)pyrimidin-4-yl]amino]-3,5-dimethylbenzonitrile Traditional Name: 4-[[2-(2-amino-3-cyano-phenyl)pyrimidin-4-yl]amino]-3,5-dimethyl-benzonitrile Formula: C20H16N6 MolecularWeight: 340.38124

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC2=NC(=NC=C2)C3=CC=CC(=C3N)C#N)C)C#N

Isomeric SMILES

CC1=CC(=CC(=C1NC2=NC(=NC=C2)C3=CC=CC(=C3N)C#N)C)C#N

InChI

InChI=1S/C20H16N6/c1-12-8-14(10-21)9-13(2)19(12)25-17-6-7-24-20(26-17)16-5-3-4-15(11-22)18(16)23/h3-9H,23H2,1-2H3,(H,24,25,26)