5-chloranyl-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1-(phenylmethyl)benzimidazole

Systemtic Name: 5-chloranyl-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1-(phenylmethyl)benzimidazole Openeye Name: 1-benzyl-5-chloro-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzimidazole CAS Name: 5-chloro-2-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-1-(phenylmethyl)benzimidazole IUPAC Name: 1-benzyl-5-chloro-2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]benzimidazole Traditional Name: 1-benzyl-5-chloro-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]benzimidazole Formula: C20H18ClN5O2 MolecularWeight: 395.84222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NC3=C(N2CC4=CC=CC=C4)C=CC(=C3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C20H18ClN5O2/c1-13-20(26(27)28)14(2)25(23-13)12-19-22-17-10-16(21)8-9-18(17)24(19)11-15-6-4-3-5-7-15/h3-10H,11-12H2,1-2H3