1-(6-azanylhexyl)-2-(2,2-dimethylpropyl)-N-(4-pentoxyphenyl)benzimidazole-4-carboxamide

Systemtic Name: 1-(6-azanylhexyl)-2-(2,2-dimethylpropyl)-N-(4-pentoxyphenyl)benzimidazole-4-carboxamide Openeye Name: 1-(6-aminohexyl)-2-(2,2-dimethylpropyl)-N-(4-pentoxyphenyl)benzimidazole-4-carboxamide CAS Name: 1-(6-aminohexyl)-2-(2,2-dimethylpropyl)-N-(4-pentoxyphenyl)-4-benzimidazolecarboxamide IUPAC Name: 1-(6-aminohexyl)-2-(2,2-dimethylpropyl)-N-(4-pentoxyphenyl)benzimidazole-4-carboxamide Traditional Name: 1-(6-aminohexyl)-N-(4-amoxyphenyl)-2-neopentyl-benzimidazole-4-carboxamide Formula: C30H44N4O2 MolecularWeight: 492.69596

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)NC(=O)C2=C3C(=CC=C2)N(C(=N3)CC(C)(C)C)CCCCCCN

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)NC(=O)C2=C3C(=CC=C2)N(C(=N3)CC(C)(C)C)CCCCCCN

InChI

InChI=1S/C30H44N4O2/c1-5-6-11-21-36-24-17-15-23(16-18-24)32-29(35)25-13-12-14-26-28(25)33-27(22-30(2,3)4)34(26)20-10-8-7-9-19-31/h12-18H,5-11,19-22,31H2,1-4H3,(H,32,35)