(4-tert-butylphenyl)-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-[6-methyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-[6-methyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-[6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]methanone Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=CC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=CC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)C(C)(C)C)C

InChI

InChI=1S/C27H32N4O/c1-19-7-6-8-22(17-19)25-28-20(2)18-24(29-25)30-13-15-31(16-14-30)26(32)21-9-11-23(12-10-21)27(3,4)5/h6-12,17-18H,13-16H2,1-5H3