2-(4-chloranylphenoxy)-1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]ethanone

Systemtic Name: 2-(4-chloranylphenoxy)-1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]ethanone Openeye Name: 2-(4-chlorophenoxy)-1-[4-[5-isopropyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazin-1-yl]ethanone CAS Name: 2-(4-chlorophenoxy)-1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-yl-4-pyrimidinyl]-1-piperazinyl]ethanone IUPAC Name: 2-(4-chlorophenoxy)-1-[4-[6-methyl-2-(3-methylphenyl)-5-propan-2-ylpyrimidin-4-yl]piperazin-1-yl]ethanone Traditional Name: 2-(4-chlorophenoxy)-1-[4-[5-isopropyl-6-methyl-2-(m-tolyl)pyrimidin-4-yl]piperazino]ethanone Formula: C27H31ClN4O2 MolecularWeight: 479.01364

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)COC4=CC=C(C=C4)Cl)C(C)C)C

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)COC4=CC=C(C=C4)Cl)C(C)C)C

InChI

InChI=1S/C27H31ClN4O2/c1-18(2)25-20(4)29-26(21-7-5-6-19(3)16-21)30-27(25)32-14-12-31(13-15-32)24(33)17-34-23-10-8-22(28)9-11-23/h5-11,16,18H,12-15,17H2,1-4H3