1-butyl-2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzimidazole-5-sulfonamide

Systemtic Name: 1-butyl-2-[[3-chloranyl-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Openeye Name: 1-butyl-2-[[3-chloro-5-(trifluoromethyl)-2-pyridyl]sulfanylmethyl]benzimidazole-5-sulfonamide CAS Name: 1-butyl-2-[[[3-chloro-5-(trifluoromethyl)-2-pyridinyl]thio]methyl]-5-benzimidazolesulfonamide IUPAC Name: 1-butyl-2-[[3-chloro-5-(trifluoromethyl)pyridin-2-yl]sulfanylmethyl]benzimidazole-5-sulfonamide Traditional Name: 1-butyl-2-[[[3-chloro-5-(trifluoromethyl)-2-pyridyl]thio]methyl]benzimidazole-5-sulfonamide Formula: C18H18ClF3N4O2S2 MolecularWeight: 478.93933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=C(C=C(C=N3)C(F)(F)F)Cl

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CSC3=C(C=C(C=N3)C(F)(F)F)Cl

InChI

InChI=1S/C18H18ClF3N4O2S2/c1-2-3-6-26-15-5-4-12(30(23,27)28)8-14(15)25-16(26)10-29-17-13(19)7-11(9-24-17)18(20,21)22/h4-5,7-9H,2-3,6,10H2,1H3,(H2,23,27,28)