2-methyl-N-(3-methylphenyl)-4-[1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-4-yl]carbonyl-piperazine-1-carboxamide

Systemtic Name: 2-methyl-N-(3-methylphenyl)-4-[1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazol-4-yl]carbonyl-piperazine-1-carboxamide Openeye Name: 2-methyl-N-(m-tolyl)-4-[1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperazine-1-carboxamide CAS Name: 2-methyl-N-(3-methylphenyl)-4-[[1-(4-nitrophenyl)-5-(trifluoromethyl)-4-pyrazolyl]-oxomethyl]-1-piperazinecarboxamide IUPAC Name: 2-methyl-N-(3-methylphenyl)-4-[1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperazine-1-carboxamide Traditional Name: 2-methyl-N-(m-tolyl)-4-[1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carbonyl]piperazine-1-carboxamide Formula: C24H23F3N6O4 MolecularWeight: 516.47243

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C(=O)NC2=CC=CC(=C2)C)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

CC1CN(CCN1C(=O)NC2=CC=CC(=C2)C)C(=O)C3=C(N(N=C3)C4=CC=C(C=C4)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C24H23F3N6O4/c1-15-4-3-5-17(12-15)29-23(35)31-11-10-30(14-16(31)2)22(34)20-13-28-32(21(20)24(25,26)27)18-6-8-19(9-7-18)33(36)37/h3-9,12-13,16H,10-11,14H2,1-2H3,(H,29,35)