N-butylsulfonyl-3-[[2-chloranyl-4-(trifluoromethyl)phenyl]methyl]-2-methyl-benzimidazole-5-carboxamide

Systemtic Name: N-butylsulfonyl-3-[[2-chloranyl-4-(trifluoromethyl)phenyl]methyl]-2-methyl-benzimidazole-5-carboxamide Openeye Name: N-butylsulfonyl-3-[[2-chloro-4-(trifluoromethyl)phenyl]methyl]-2-methyl-benzimidazole-5-carboxamide CAS Name: N-butylsulfonyl-3-[[2-chloro-4-(trifluoromethyl)phenyl]methyl]-2-methyl-5-benzimidazolecarboxamide IUPAC Name: N-butylsulfonyl-3-[[2-chloro-4-(trifluoromethyl)phenyl]methyl]-2-methylbenzimidazole-5-carboxamide Traditional Name: N-butylsulfonyl-3-[2-chloro-4-(trifluoromethyl)benzyl]-2-methyl-benzimidazole-5-carboxamide Formula: C21H21ClF3N3O3S MolecularWeight: 487.92295

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Descriptors Computed from Structure

Canonical SMILES:

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)C(F)(F)F)Cl)C

Isomeric SMILES

CCCCS(=O)(=O)NC(=O)C1=CC2=C(C=C1)N=C(N2CC3=C(C=C(C=C3)C(F)(F)F)Cl)C

InChI

InChI=1S/C21H21ClF3N3O3S/c1-3-4-9-32(30,31)27-20(29)14-6-8-18-19(10-14)28(13(2)26-18)12-15-5-7-16(11-17(15)22)21(23,24)25/h5-8,10-11H,3-4,9,12H2,1-2H3,(H,27,29)