3-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]-N-[2-(2-phenylpropoxy)ethyl]propane-1-sulfonamide

Systemtic Name: 3-[2-(4-oxidanyl-2-oxidanylidene-3H-1,3-benzothiazol-7-yl)ethylamino]-N-[2-(2-phenylpropoxy)ethyl]propane-1-sulfonamide Openeye Name: 3-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]-N-[2-(2-phenylpropoxy)ethyl]propane-1-sulfonamide CAS Name: 3-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]-N-[2-(2-phenylpropoxy)ethyl]-1-propanesulfonamide IUPAC Name: 3-[2-(4-hydroxy-2-oxo-3H-1,3-benzothiazol-7-yl)ethylamino]-N-[2-(2-phenylpropoxy)ethyl]propane-1-sulfonamide Traditional Name: 3-[2-(4-hydroxy-2-keto-3H-1,3-benzothiazol-7-yl)ethylamino]-N-[2-(2-phenylpropoxy)ethyl]propane-1-sulfonamide Formula: C23H31N3O5S2 MolecularWeight: 493.63934

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Descriptors Computed from Structure

Canonical SMILES:

CC(COCCNS(=O)(=O)CCCNCCC1=C2C(=C(C=C1)O)NC(=O)S2)C3=CC=CC=C3

Isomeric SMILES

CC(COCCNS(=O)(=O)CCCNCCC1=C2C(=C(C=C1)O)NC(=O)S2)C3=CC=CC=C3

InChI

InChI=1S/C23H31N3O5S2/c1-17(18-6-3-2-4-7-18)16-31-14-13-25-33(29,30)15-5-11-24-12-10-19-8-9-20(27)21-22(19)32-23(28)26-21/h2-4,6-9,17,24-25,27H,5,10-16H2,1H3,(H,26,28)