5-chloranyl-2-methoxy-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]benzenesulfonamide

Systemtic Name: 5-chloranyl-2-methoxy-N-[3-(4-thiomorpholin-4-ylcarbonyl-1,2,3-triazol-1-yl)propyl]benzenesulfonamide Openeye Name: 5-chloro-2-methoxy-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]benzenesulfonamide CAS Name: 5-chloro-2-methoxy-N-[3-[4-[oxo(thiomorpholin-4-yl)methyl]-1-triazolyl]propyl]benzenesulfonamide IUPAC Name: 5-chloro-2-methoxy-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]benzenesulfonamide Traditional Name: 5-chloro-2-methoxy-N-[3-[4-(thiomorpholine-4-carbonyl)triazol-1-yl]propyl]benzenesulfonamide Formula: C17H22ClN5O4S2 MolecularWeight: 459.97068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NCCCN2C=C(N=N2)C(=O)N3CCSCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Cl)S(=O)(=O)NCCCN2C=C(N=N2)C(=O)N3CCSCC3

InChI

InChI=1S/C17H22ClN5O4S2/c1-27-15-4-3-13(18)11-16(15)29(25,26)19-5-2-6-23-12-14(20-21-23)17(24)22-7-9-28-10-8-22/h3-4,11-12,19H,2,5-10H2,1H3