(4-tert-butylphenyl)-[4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: (4-tert-butylphenyl)-[4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: (4-tert-butylphenyl)-[4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: (4-tert-butylphenyl)-[4-[5,6-dimethyl-2-(3-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: (4-tert-butylphenyl)-[4-[5,6-dimethyl-2-(3-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: (4-tert-butylphenyl)-[4-[5,6-dimethyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]methanone Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N4O/c1-19-8-7-9-23(18-19)25-29-21(3)20(2)26(30-25)31-14-16-32(17-15-31)27(33)22-10-12-24(13-11-22)28(4,5)6/h7-13,18H,14-17H2,1-6H3