[4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone

Systemtic Name: [4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-pyrimidin-4-yl]piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone Openeye Name: [4-[5-isopropyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone CAS Name: [4-[6-methyl-2-(4-methylphenyl)-5-propan-2-yl-4-pyrimidinyl]-1-piperazinyl]-(4-methyl-3-nitrophenyl)methanone IUPAC Name: [4-[6-methyl-2-(4-methylphenyl)-5-propan-2-ylpyrimidin-4-yl]piperazin-1-yl]-(4-methyl-3-nitrophenyl)methanone Traditional Name: [4-[5-isopropyl-6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]-(4-methyl-3-nitro-phenyl)methanone Formula: C27H31N5O3 MolecularWeight: 473.56674

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C(C)C)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=C(C(=N2)N3CCN(CC3)C(=O)C4=CC(=C(C=C4)C)[N+](=O)[O-])C(C)C)C

InChI

InChI=1S/C27H31N5O3/c1-17(2)24-20(5)28-25(21-9-6-18(3)7-10-21)29-26(24)30-12-14-31(15-13-30)27(33)22-11-8-19(4)23(16-22)32(34)35/h6-11,16-17H,12-15H2,1-5H3