[4-(2-methylpropyl)phenyl]-[4-(2-phenylpyrimidin-4-yl)piperidin-1-yl]methanone

Systemtic Name: [4-(2-methylpropyl)phenyl]-[4-(2-phenylpyrimidin-4-yl)piperidin-1-yl]methanone Openeye Name: (4-isobutylphenyl)-[4-(2-phenylpyrimidin-4-yl)-1-piperidyl]methanone CAS Name: [4-(2-methylpropyl)phenyl]-[4-(2-phenyl-4-pyrimidinyl)-1-piperidinyl]methanone IUPAC Name: [4-(2-methylpropyl)phenyl]-[4-(2-phenylpyrimidin-4-yl)piperidin-1-yl]methanone Traditional Name: (4-isobutylphenyl)-[4-(2-phenylpyrimidin-4-yl)piperidino]methanone Formula: C26H29N3O MolecularWeight: 399.52796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=NC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(=O)N2CCC(CC2)C3=NC(=NC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N3O/c1-19(2)18-20-8-10-23(11-9-20)26(30)29-16-13-21(14-17-29)24-12-15-27-25(28-24)22-6-4-3-5-7-22/h3-12,15,19,21H,13-14,16-18H2,1-2H3