[3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-yl]methanone

Systemtic Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-yl]methanone Openeye Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazin-1-yl]methanone CAS Name: [3-(3,4-dimethylphenyl)-1-phenyl-4-pyrazolyl]-[4-(3-methyl-5-nitro-4-imidazolyl)-1-piperazinyl]methanone IUPAC Name: [3-(3,4-dimethylphenyl)-1-phenylpyrazol-4-yl]-[4-(3-methyl-5-nitroimidazol-4-yl)piperazin-1-yl]methanone Traditional Name: [3-(3,4-dimethylphenyl)-1-phenyl-pyrazol-4-yl]-[4-(3-methyl-5-nitro-imidazol-4-yl)piperazino]methanone Formula: C26H27N7O3 MolecularWeight: 485.53768

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C4=C(N=CN4C)[N+](=O)[O-])C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=NN(C=C2C(=O)N3CCN(CC3)C4=C(N=CN4C)[N+](=O)[O-])C5=CC=CC=C5)C

InChI

InChI=1S/C26H27N7O3/c1-18-9-10-20(15-19(18)2)23-22(16-32(28-23)21-7-5-4-6-8-21)26(34)31-13-11-30(12-14-31)25-24(33(35)36)27-17-29(25)3/h4-10,15-17H,11-14H2,1-3H3