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

Systemtic Name: cyclopropyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]methanone Openeye Name: cyclopropyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: cyclopropyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenyl-4-pyrimidinyl]-1-piperazinyl]methanone IUPAC Name: cyclopropyl-[4-[5-[(2,5-dimethylphenyl)methyl]-6-ethyl-2-phenylpyrimidin-4-yl]piperazin-1-yl]methanone Traditional Name: cyclopropyl-[4-[5-(2,5-dimethylbenzyl)-6-ethyl-2-phenyl-pyrimidin-4-yl]piperazino]methanone Formula: C29H34N4O MolecularWeight: 454.60646

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CC4)CC5=C(C=CC(=C5)C)C

Isomeric SMILES

CCC1=C(C(=NC(=N1)C2=CC=CC=C2)N3CCN(CC3)C(=O)C4CC4)CC5=C(C=CC(=C5)C)C

InChI

InChI=1S/C29H34N4O/c1-4-26-25(19-24-18-20(2)10-11-21(24)3)28(31-27(30-26)22-8-6-5-7-9-22)32-14-16-33(17-15-32)29(34)23-12-13-23/h5-11,18,23H,4,12-17,19H2,1-3H3