N-butyl-6-(2-methoxyethanoylamino)-3-methyl-2-pyridin-4-yl-benzimidazole-4-carboxamide

Systemtic Name: N-butyl-6-(2-methoxyethanoylamino)-3-methyl-2-pyridin-4-yl-benzimidazole-4-carboxamide Openeye Name: N-butyl-6-[(2-methoxyacetyl)amino]-3-methyl-2-(4-pyridyl)benzimidazole-4-carboxamide CAS Name: N-butyl-6-[(2-methoxy-1-oxoethyl)amino]-3-methyl-2-pyridin-4-yl-4-benzimidazolecarboxamide IUPAC Name: N-butyl-6-[(2-methoxyacetyl)amino]-3-methyl-2-pyridin-4-ylbenzimidazole-4-carboxamide Traditional Name: N-butyl-6-[(2-methoxyacetyl)amino]-3-methyl-2-(4-pyridyl)benzimidazole-4-carboxamide Formula: C21H25N5O3 MolecularWeight: 395.4549

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C1=CC(=CC2=C1N(C(=N2)C3=CC=NC=C3)C)NC(=O)COC

Isomeric SMILES

CCCCNC(=O)C1=CC(=CC2=C1N(C(=N2)C3=CC=NC=C3)C)NC(=O)COC

InChI

InChI=1S/C21H25N5O3/c1-4-5-8-23-21(28)16-11-15(24-18(27)13-29-3)12-17-19(16)26(2)20(25-17)14-6-9-22-10-7-14/h6-7,9-12H,4-5,8,13H2,1-3H3,(H,23,28)(H,24,27)