4-[3-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol

Systemtic Name: 4-[3-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]methylamino]-2-oxidanyl-propoxy]phenol Openeye Name: 4-[3-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-piperidyl]methylamino]-2-hydroxy-propoxy]phenol CAS Name: 4-[3-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)-4-piperidinyl]methylamino]-2-hydroxypropoxy]phenol IUPAC Name: 4-[3-[[1-(2,1,3-benzothiadiazol-4-ylsulfonyl)piperidin-4-yl]methylamino]-2-hydroxypropoxy]phenol Traditional Name: 4-[2-hydroxy-3-[(1-piazthiol-4-ylsulfonyl-4-piperidyl)methylamino]propoxy]phenol Formula: C21H26N4O5S2 MolecularWeight: 478.58494

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CNCC(COC2=CC=C(C=C2)O)O)S(=O)(=O)C3=CC=CC4=NSN=C43

Isomeric SMILES

C1CN(CCC1CNCC(COC2=CC=C(C=C2)O)O)S(=O)(=O)C3=CC=CC4=NSN=C43

InChI

InChI=1S/C21H26N4O5S2/c26-16-4-6-18(7-5-16)30-14-17(27)13-22-12-15-8-10-25(11-9-15)32(28,29)20-3-1-2-19-21(20)24-31-23-19/h1-7,15,17,22,26-27H,8-14H2