[4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-(4-hexylphenyl)methanone

Systemtic Name: [4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-(4-hexylphenyl)methanone Openeye Name: [4-[6-ethyl-2-methyl-5-(p-tolylmethyl)pyrimidin-4-yl]piperazin-1-yl]-(4-hexylphenyl)methanone CAS Name: [4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]-4-pyrimidinyl]-1-piperazinyl]-(4-hexylphenyl)methanone IUPAC Name: [4-[6-ethyl-2-methyl-5-[(4-methylphenyl)methyl]pyrimidin-4-yl]piperazin-1-yl]-(4-hexylphenyl)methanone Traditional Name: [4-[6-ethyl-2-methyl-5-(4-methylbenzyl)pyrimidin-4-yl]piperazino]-(4-hexylphenyl)methanone Formula: C32H42N4O MolecularWeight: 498.70208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=C(C=C4)C)CC)C

Isomeric SMILES

CCCCCCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC(=NC(=C3CC4=CC=C(C=C4)C)CC)C

InChI

InChI=1S/C32H42N4O/c1-5-7-8-9-10-26-15-17-28(18-16-26)32(37)36-21-19-35(20-22-36)31-29(30(6-2)33-25(4)34-31)23-27-13-11-24(3)12-14-27/h11-18H,5-10,19-23H2,1-4H3