N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)benzimidazole-5-carboxamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)benzimidazole-5-carboxamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-isopropylphenyl)benzimidazole-5-carboxamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)-5-benzimidazolecarboxamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(4-propan-2-ylphenyl)benzimidazole-5-carboxamide Traditional Name: 1-p-cumenyl-N-piperonyl-benzimidazole-5-carboxamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)N2C=NC3=C2C=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)N2C=NC3=C2C=CC(=C3)C(=O)NCC4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C25H23N3O3/c1-16(2)18-4-7-20(8-5-18)28-14-27-21-12-19(6-9-22(21)28)25(29)26-13-17-3-10-23-24(11-17)31-15-30-23/h3-12,14,16H,13,15H2,1-2H3,(H,26,29)