3-[(4-butyl-2-chloranyl-phenyl)methyl]-2-methyl-N-pentylsulfonyl-benzimidazole-5-carboxamide

Systemtic Name: 3-[(4-butyl-2-chloranyl-phenyl)methyl]-2-methyl-N-pentylsulfonyl-benzimidazole-5-carboxamide Openeye Name: 3-[(4-butyl-2-chloro-phenyl)methyl]-2-methyl-N-pentylsulfonyl-benzimidazole-5-carboxamide CAS Name: 3-[(4-butyl-2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonyl-5-benzimidazolecarboxamide IUPAC Name: 3-[(4-butyl-2-chlorophenyl)methyl]-2-methyl-N-pentylsulfonylbenzimidazole-5-carboxamide Traditional Name: N-amylsulfonyl-3-(4-butyl-2-chloro-benzyl)-2-methyl-benzimidazole-5-carboxamide Formula: C25H32ClN3O3S MolecularWeight: 490.05788

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)CCCC)Cl)C

Isomeric SMILES

CCCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)CCCC)Cl)C

InChI

InChI=1S/C25H32ClN3O3S/c1-4-6-8-14-33(31,32)28-25(30)20-12-13-23-24(16-20)29(18(3)27-23)17-21-11-10-19(9-7-5-2)15-22(21)26/h10-13,15-16H,4-9,14,17H2,1-3H3,(H,28,30)