4-cyano-N-[3-[[4-(4-imidazol-1-ylphenyl)pyrimidin-2-yl]amino]-4-methyl-phenyl]benzamide

Systemtic Name: 4-cyano-N-[3-[[4-(4-imidazol-1-ylphenyl)pyrimidin-2-yl]amino]-4-methyl-phenyl]benzamide Openeye Name: 4-cyano-N-[3-[[4-(4-imidazol-1-ylphenyl)pyrimidin-2-yl]amino]-4-methyl-phenyl]benzamide CAS Name: 4-cyano-N-[3-[[4-[4-(1-imidazolyl)phenyl]-2-pyrimidinyl]amino]-4-methylphenyl]benzamide IUPAC Name: 4-cyano-N-[3-[[4-(4-imidazol-1-ylphenyl)pyrimidin-2-yl]amino]-4-methylphenyl]benzamide Traditional Name: 4-cyano-N-[3-[[4-(4-imidazol-1-ylphenyl)pyrimidin-2-yl]amino]-4-methyl-phenyl]benzamide Formula: C28H21N7O MolecularWeight: 471.51264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C#N)NC3=NC=CC(=N3)C4=CC=C(C=C4)N5C=CN=C5

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C#N)NC3=NC=CC(=N3)C4=CC=C(C=C4)N5C=CN=C5

InChI

InChI=1S/C28H21N7O/c1-19-2-9-23(32-27(36)22-5-3-20(17-29)4-6-22)16-26(19)34-28-31-13-12-25(33-28)21-7-10-24(11-8-21)35-15-14-30-18-35/h2-16,18H,1H3,(H,32,36)(H,31,33,34)