N-[3-(2-methylbenzimidazol-1-yl)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide

Systemtic Name: N-[3-(2-methylbenzimidazol-1-yl)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Openeye Name: N-[3-(2-methylbenzimidazol-1-yl)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide CAS Name: N-[3-(2-methyl-1-benzimidazolyl)propyl]-1-(3-nitrophenyl)-3-pyrazolecarboxamide IUPAC Name: N-[3-(2-methylbenzimidazol-1-yl)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Traditional Name: N-[3-(2-methylbenzimidazol-1-yl)propyl]-1-(3-nitrophenyl)pyrazole-3-carboxamide Formula: C21H20N6O3 MolecularWeight: 404.4219

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2N1CCCNC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

CC1=NC2=CC=CC=C2N1CCCNC(=O)C3=NN(C=C3)C4=CC(=CC=C4)[N+](=O)[O-]

InChI

InChI=1S/C21H20N6O3/c1-15-23-18-8-2-3-9-20(18)25(15)12-5-11-22-21(28)19-10-13-26(24-19)16-6-4-7-17(14-16)27(29)30/h2-4,6-10,13-14H,5,11-12H2,1H3,(H,22,28)