2-[[4-(propanoylamino)phenyl]methyl]-N-[(4-propan-2-yloxyphenyl)methyl]-3H-benzimidazole-5-carboxamide

Systemtic Name: 2-[[4-(propanoylamino)phenyl]methyl]-N-[(4-propan-2-yloxyphenyl)methyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(4-isopropoxyphenyl)methyl]-2-[[4-(propanoylamino)phenyl]methyl]-3H-benzimidazole-5-carboxamide CAS Name: 2-[[4-(1-oxopropylamino)phenyl]methyl]-N-[(4-propan-2-yloxyphenyl)methyl]-3H-benzimidazole-5-carboxamide IUPAC Name: 2-[[4-(propanoylamino)phenyl]methyl]-N-[(4-propan-2-yloxyphenyl)methyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(4-isopropoxybenzyl)-2-(4-propionamidobenzyl)-3H-benzimidazole-5-carboxamide Formula: C28H30N4O3 MolecularWeight: 470.5628

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)CC2=NC3=C(N2)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)OC(C)C

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)CC2=NC3=C(N2)C=C(C=C3)C(=O)NCC4=CC=C(C=C4)OC(C)C

InChI

InChI=1S/C28H30N4O3/c1-4-27(33)30-22-10-5-19(6-11-22)15-26-31-24-14-9-21(16-25(24)32-26)28(34)29-17-20-7-12-23(13-8-20)35-18(2)3/h5-14,16,18H,4,15,17H2,1-3H3,(H,29,34)(H,30,33)(H,31,32)