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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[[4-(propanoylamino)phenyl]methyl]-3H-benzimidazole-5-carboxamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[[4-(propanoylamino)phenyl]methyl]-3H-benzimidazole-5-carboxamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[[4-(1-oxopropylamino)phenyl]methyl]-3H-benzimidazole-5-carboxamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[[4-(propanoylamino)phenyl]methyl]-3H-benzimidazole-5-carboxamide Traditional Name: N-(4-chlorobenzyl)-2-(4-propionamidobenzyl)-3H-benzimidazole-5-carboxamide Formula: C25H23ClN4O2 MolecularWeight: 446.92872

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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)Cl

Isomeric SMILES

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

InChI

InChI=1S/C25H23ClN4O2/c1-2-24(31)28-20-10-5-16(6-11-20)13-23-29-21-12-7-18(14-22(21)30-23)25(32)27-15-17-3-8-19(26)9-4-17/h3-12,14H,2,13,15H2,1H3,(H,27,32)(H,28,31)(H,29,30)