5-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]-2-(4-methylimidazol-1-yl)benzenecarbonitrile

Systemtic Name: 5-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]-2-(4-methylimidazol-1-yl)benzenecarbonitrile Openeye Name: 5-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]-2-(4-methylimidazol-1-yl)benzonitrile CAS Name: 5-[[4-(4-chlorophenyl)-2-pyrimidinyl]amino]-2-(4-methyl-1-imidazolyl)benzonitrile IUPAC Name: 5-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]-2-(4-methylimidazol-1-yl)benzonitrile Traditional Name: 5-[[4-(4-chlorophenyl)pyrimidin-2-yl]amino]-2-(4-methylimidazol-1-yl)benzonitrile Formula: C21H15ClN6 MolecularWeight: 386.837

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C=N1)C2=C(C=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)Cl)C#N

Isomeric SMILES

CC1=CN(C=N1)C2=C(C=C(C=C2)NC3=NC=CC(=N3)C4=CC=C(C=C4)Cl)C#N

InChI

InChI=1S/C21H15ClN6/c1-14-12-28(13-25-14)20-7-6-18(10-16(20)11-23)26-21-24-9-8-19(27-21)15-2-4-17(22)5-3-15/h2-10,12-13H,1H3,(H,24,26,27)