[4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-phenyl-2-pyridin-4-yl-pyrimidin-5-yl)methanone

Systemtic Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-phenyl-2-pyridin-4-yl-pyrimidin-5-yl)methanone Openeye Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-[4-phenyl-2-(4-pyridyl)pyrimidin-5-yl]methanone CAS Name: [4-(2,5-dimethylphenyl)-1-piperazinyl]-(4-phenyl-2-pyridin-4-yl-5-pyrimidinyl)methanone IUPAC Name: [4-(2,5-dimethylphenyl)piperazin-1-yl]-(4-phenyl-2-pyridin-4-ylpyrimidin-5-yl)methanone Traditional Name: [4-(2,5-dimethylphenyl)piperazino]-[4-phenyl-2-(4-pyridyl)pyrimidin-5-yl]methanone Formula: C28H27N5O MolecularWeight: 449.54688

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4)C5=CC=NC=C5

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)C3=CN=C(N=C3C4=CC=CC=C4)C5=CC=NC=C5

InChI

InChI=1S/C28H27N5O/c1-20-8-9-21(2)25(18-20)32-14-16-33(17-15-32)28(34)24-19-30-27(23-10-12-29-13-11-23)31-26(24)22-6-4-3-5-7-22/h3-13,18-19H,14-17H2,1-2H3