5-[3-[[2-(3H-benzimidazol-5-yloxy)-2-oxidanyl-ethyl]amino]butyl]thiophene-2-sulfonamide

Systemtic Name: 5-[3-[[2-(3H-benzimidazol-5-yloxy)-2-oxidanyl-ethyl]amino]butyl]thiophene-2-sulfonamide Openeye Name: 5-[3-[[2-(3H-benzimidazol-5-yloxy)-2-hydroxy-ethyl]amino]butyl]thiophene-2-sulfonamide CAS Name: 5-[3-[[2-(3H-benzimidazol-5-yloxy)-2-hydroxyethyl]amino]butyl]-2-thiophenesulfonamide IUPAC Name: 5-[3-[[2-(3H-benzimidazol-5-yloxy)-2-hydroxyethyl]amino]butyl]thiophene-2-sulfonamide Traditional Name: 5-[3-[[2-(3H-benzimidazol-5-yloxy)-2-hydroxy-ethyl]amino]butyl]thiophene-2-sulfonamide Formula: C17H22N4O4S2 MolecularWeight: 410.51098

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC1=CC=C(S1)S(=O)(=O)N)NCC(O)OC2=CC3=C(C=C2)N=CN3

Isomeric SMILES

CC(CCC1=CC=C(S1)S(=O)(=O)N)NCC(O)OC2=CC3=C(C=C2)N=CN3

InChI

InChI=1S/C17H22N4O4S2/c1-11(2-4-13-5-7-17(26-13)27(18,23)24)19-9-16(22)25-12-3-6-14-15(8-12)21-10-20-14/h3,5-8,10-11,16,19,22H,2,4,9H2,1H3,(H,20,21)(H2,18,23,24)