6-[[1-(2-morpholin-4-ylethyl)-1,2,3-triazol-4-yl]methoxy]-1,3-benzothiazole-2-sulfonamide

Systemtic Name: 6-[[1-(2-morpholin-4-ylethyl)-1,2,3-triazol-4-yl]methoxy]-1,3-benzothiazole-2-sulfonamide Openeye Name: 6-[[1-(2-morpholinoethyl)triazol-4-yl]methoxy]-1,3-benzothiazole-2-sulfonamide CAS Name: 6-[[1-[2-(4-morpholinyl)ethyl]-4-triazolyl]methoxy]-1,3-benzothiazole-2-sulfonamide IUPAC Name: 6-[[1-(2-morpholin-4-ylethyl)triazol-4-yl]methoxy]-1,3-benzothiazole-2-sulfonamide Traditional Name: 6-[[1-(2-morpholinoethyl)triazol-4-yl]methoxy]-1,3-benzothiazole-2-sulfonamide Formula: C16H20N6O4S2 MolecularWeight: 424.4978

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCN2C=C(N=N2)COC3=CC4=C(C=C3)N=C(S4)S(=O)(=O)N

Isomeric SMILES

C1COCCN1CCN2C=C(N=N2)COC3=CC4=C(C=C3)N=C(S4)S(=O)(=O)N

InChI

InChI=1S/C16H20N6O4S2/c17-28(23,24)16-18-14-2-1-13(9-15(14)27-16)26-11-12-10-22(20-19-12)4-3-21-5-7-25-8-6-21/h1-2,9-10H,3-8,11H2,(H2,17,23,24)