2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide

Systemtic Name: 2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]ethanamide Openeye Name: 2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide CAS Name: 2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide IUPAC Name: 2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Traditional Name: 2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]-N-[2-(4-sulfamoylphenyl)ethyl]acetamide Formula: C17H18N6O3S2 MolecularWeight: 418.49322

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCNC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)S(=O)(=O)N

Isomeric SMILES

C1=CC(=CC=C1CCNC(=O)CSC2=NNC(=N2)C3=CC=NC=C3)S(=O)(=O)N

InChI

InChI=1S/C17H18N6O3S2/c18-28(25,26)14-3-1-12(2-4-14)5-10-20-15(24)11-27-17-21-16(22-23-17)13-6-8-19-9-7-13/h1-4,6-9H,5,10-11H2,(H,20,24)(H2,18,25,26)(H,21,22,23)