2-methyl-1-[4-[6-methyl-5-[(2-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one

Systemtic Name: 2-methyl-1-[4-[6-methyl-5-[(2-methylphenyl)methyl]-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one Openeye Name: 2-methyl-1-[4-[6-methyl-5-(o-tolylmethyl)-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]propan-1-one CAS Name: 2-methyl-1-[4-[6-methyl-5-[(2-methylphenyl)methyl]-2-phenyl-4-pyrimidinyl]-1-piperazinyl]-1-propanone IUPAC Name: 2-methyl-1-[4-[6-methyl-5-[(2-methylphenyl)methyl]-2-phenylpyrimidin-4-yl]piperazin-1-yl]propan-1-one Traditional Name: 2-methyl-1-[4-[6-methyl-5-(2-methylbenzyl)-2-phenyl-pyrimidin-4-yl]piperazino]propan-1-one Formula: C27H32N4O MolecularWeight: 428.56918

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC2=C(N=C(N=C2N3CCN(CC3)C(=O)C(C)C)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC=CC=C1CC2=C(N=C(N=C2N3CCN(CC3)C(=O)C(C)C)C4=CC=CC=C4)C

InChI

InChI=1S/C27H32N4O/c1-19(2)27(32)31-16-14-30(15-17-31)26-24(18-23-13-9-8-10-20(23)3)21(4)28-25(29-26)22-11-6-5-7-12-22/h5-13,19H,14-18H2,1-4H3