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

Systemtic Name: [4-[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-(4-methyl-3-nitro-phenyl)methanone Openeye Name: (4-methyl-3-nitro-phenyl)-[4-[6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazin-1-yl]methanone CAS Name: [4-[6-methyl-2-(4-methylphenyl)-4-pyrimidinyl]-1-piperazinyl]-(4-methyl-3-nitrophenyl)methanone IUPAC Name: [4-[6-methyl-2-(4-methylphenyl)pyrimidin-4-yl]piperazin-1-yl]-(4-methyl-3-nitrophenyl)methanone Traditional Name: (4-methyl-3-nitro-phenyl)-[4-[6-methyl-2-(p-tolyl)pyrimidin-4-yl]piperazino]methanone Formula: C24H25N5O3 MolecularWeight: 431.487

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H25N5O3/c1-16-4-7-19(8-5-16)23-25-18(3)14-22(26-23)27-10-12-28(13-11-27)24(30)20-9-6-17(2)21(15-20)29(31)32/h4-9,14-15H,10-13H2,1-3H3