2-[[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]methyl]-1-butyl-benzimidazole-5-sulfonamide

Systemtic Name: 2-[[(5-bromanylthiophen-2-yl)methyl-ethyl-amino]methyl]-1-butyl-benzimidazole-5-sulfonamide Openeye Name: 2-[[(5-bromo-2-thienyl)methyl-ethyl-amino]methyl]-1-butyl-benzimidazole-5-sulfonamide CAS Name: 2-[[(5-bromo-2-thiophenyl)methyl-ethylamino]methyl]-1-butyl-5-benzimidazolesulfonamide IUPAC Name: 2-[[(5-bromothiophen-2-yl)methyl-ethylamino]methyl]-1-butylbenzimidazole-5-sulfonamide Traditional Name: 2-[[(5-bromo-2-thienyl)methyl-ethyl-amino]methyl]-1-butyl-benzimidazole-5-sulfonamide Formula: C19H25BrN4O2S2 MolecularWeight: 485.4614

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(CC)CC3=CC=C(S3)Br

Isomeric SMILES

CCCCN1C2=C(C=C(C=C2)S(=O)(=O)N)N=C1CN(CC)CC3=CC=C(S3)Br

InChI

InChI=1S/C19H25BrN4O2S2/c1-3-5-10-24-17-8-7-15(28(21,25)26)11-16(17)22-19(24)13-23(4-2)12-14-6-9-18(20)27-14/h6-9,11H,3-5,10,12-13H2,1-2H3,(H2,21,25,26)