2-[[butanoyl-(3-fluorophenyl)amino]methyl]-N,N-diethyl-1-propyl-benzimidazole-5-carboxamide

Systemtic Name: 2-[[butanoyl-(3-fluorophenyl)amino]methyl]-N,N-diethyl-1-propyl-benzimidazole-5-carboxamide Openeye Name: 2-[(N-butanoyl-3-fluoro-anilino)methyl]-N,N-diethyl-1-propyl-benzimidazole-5-carboxamide CAS Name: N,N-diethyl-2-[[3-fluoro-N-(1-oxobutyl)anilino]methyl]-1-propyl-5-benzimidazolecarboxamide IUPAC Name: 2-[(N-butanoyl-3-fluoroanilino)methyl]-N,N-diethyl-1-propylbenzimidazole-5-carboxamide Traditional Name: 2-[(N-butyryl-3-fluoro-anilino)methyl]-N,N-diethyl-1-propyl-benzimidazole-5-carboxamide Formula: C26H33FN4O2 MolecularWeight: 452.564223

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(CC1=NC2=C(N1CCC)C=CC(=C2)C(=O)N(CC)CC)C3=CC(=CC=C3)F

Isomeric SMILES

CCCC(=O)N(CC1=NC2=C(N1CCC)C=CC(=C2)C(=O)N(CC)CC)C3=CC(=CC=C3)F

InChI

InChI=1S/C26H33FN4O2/c1-5-10-25(32)31(21-12-9-11-20(27)17-21)18-24-28-22-16-19(26(33)29(7-3)8-4)13-14-23(22)30(24)15-6-2/h9,11-14,16-17H,5-8,10,15,18H2,1-4H3