2-methyl-3-[(4-nitrophenyl)methyl]-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide

Systemtic Name: 2-methyl-3-[(4-nitrophenyl)methyl]-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide Openeye Name: 2-methyl-3-[(4-nitrophenyl)methyl]-N-(2-pyridylmethyl)benzimidazole-5-carboxamide CAS Name: 2-methyl-3-[(4-nitrophenyl)methyl]-N-(2-pyridinylmethyl)-5-benzimidazolecarboxamide IUPAC Name: 2-methyl-3-[(4-nitrophenyl)methyl]-N-(pyridin-2-ylmethyl)benzimidazole-5-carboxamide Traditional Name: 2-methyl-3-(4-nitrobenzyl)-N-(2-pyridylmethyl)benzimidazole-5-carboxamide Formula: C22H19N5O3 MolecularWeight: 401.41796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=C(C=C3)[N+](=O)[O-])C=C(C=C2)C(=O)NCC4=CC=CC=N4

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=C(C=C3)[N+](=O)[O-])C=C(C=C2)C(=O)NCC4=CC=CC=N4

InChI

InChI=1S/C22H19N5O3/c1-15-25-20-10-7-17(22(28)24-13-18-4-2-3-11-23-18)12-21(20)26(15)14-16-5-8-19(9-6-16)27(29)30/h2-12H,13-14H2,1H3,(H,24,28)