(1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl-[(5-chloranylthiophen-2-yl)methyl]-methyl-azanium

Systemtic Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl-[(5-chloranylthiophen-2-yl)methyl]-methyl-azanium Openeye Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl-[(5-chloro-2-thienyl)methyl]-methyl-ammonium CAS Name: (1-butyl-5-sulfamoyl-2-benzimidazolyl)methyl-[(5-chloro-2-thiophenyl)methyl]-methylammonium IUPAC Name: (1-butyl-5-sulfamoylbenzimidazol-2-yl)methyl-[(5-chlorothiophen-2-yl)methyl]-methylazanium Traditional Name: (1-butyl-5-sulfamoyl-benzimidazol-2-yl)methyl-[(5-chloro-2-thienyl)methyl]-methyl-ammonium Formula: C18H24ClN4O2S2+ MolecularWeight: 427.99176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1C[NH+](C)CC3=CC=C(S3)Cl

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1C[NH+](C)CC3=CC=C(S3)Cl

InChI

InChI=1S/C18H23ClN4O2S2/c1-3-4-9-23-16-7-6-14(27(20,24)25)10-15(16)21-18(23)12-22(2)11-13-5-8-17(19)26-13/h5-8,10H,3-4,9,11-12H2,1-2H3,(H2,20,24,25)/p+1