N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-[(2-fluorophenyl)methyl]benzimidazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-[(2-fluorophenyl)methyl]benzimidazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-[(2-fluorophenyl)methyl]benzimidazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-[(2-fluorophenyl)methyl]-5-benzimidazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-cyclopropyl-3-[(2-fluorophenyl)methyl]benzimidazole-5-carboxamide Traditional Name: 2-cyclopropyl-3-(2-fluorobenzyl)-N-piperonyl-benzimidazole-5-carboxamide Formula: C26H22FN3O3 MolecularWeight: 443.469583

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC3=C(N2CC4=CC=CC=C4F)C=C(C=C3)C(=O)NCC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CC1C2=NC3=C(N2CC4=CC=CC=C4F)C=C(C=C3)C(=O)NCC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C26H22FN3O3/c27-20-4-2-1-3-19(20)14-30-22-12-18(8-9-21(22)29-25(30)17-6-7-17)26(31)28-13-16-5-10-23-24(11-16)33-15-32-23/h1-5,8-12,17H,6-7,13-15H2,(H,28,31)