cyclobutyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]methanone

Systemtic Name: cyclobutyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: cyclobutyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: cyclobutyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: cyclobutyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: cyclobutyl-[4-[5-(2,5-dimethylbenzyl)-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazino]methanone Formula: C30H36N4O MolecularWeight: 468.63304

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCC4)CC5=C(C=CC(=C5)C)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CCC4)CC5=C(C=CC(=C5)C)C

InChI

InChI=1S/C30H36N4O/c1-4-27-26(20-25-19-21(2)13-14-22(25)3)29(32-28(31-27)23-9-6-5-7-10-23)33-15-17-34(18-16-33)30(35)24-11-8-12-24/h5-7,9-10,13-14,19,24H,4,8,11-12,15-18,20H2,1-3H3