6-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1-benzothiophene-2-sulfonamide chloride

Systemtic Name: 6-[3-(tert-butylamino)-2-oxidanyl-propoxy]-1-benzothiophene-2-sulfonamide chloride Openeye Name: 6-[3-(tert-butylamino)-2-hydroxy-propoxy]benzothiophene-2-sulfonamide chloride CAS Name: 6-[3-(tert-butylamino)-2-hydroxypropoxy]-1-benzothiophene-2-sulfonamide chloride IUPAC Name: 6-[3-(tert-butylamino)-2-hydroxypropoxy]-1-benzothiophene-2-sulfonamide chloride Traditional Name: 6-[3-(tert-butylamino)-2-hydroxy-propoxy]benzothiophene-2-sulfonamide chloride Formula: C15H22ClN2O4S2- MolecularWeight: 393.92918

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC2=C(C=C1)C=C(S2)S(=O)(=O)N)O.[Cl-]

Isomeric SMILES

CC(C)(C)NCC(COC1=CC2=C(C=C1)C=C(S2)S(=O)(=O)N)O.[Cl-]

InChI

InChI=1S/C15H22N2O4S2.ClH/c1-15(2,3)17-8-11(18)9-21-12-5-4-10-6-14(23(16,19)20)22-13(10)7-12;/h4-7,11,17-18H,8-9H2,1-3H3,(H2,16,19,20);1H/p-1