2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-sulfamoylphenyl)propanamide

Systemtic Name: 2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-sulfamoylphenyl)propanamide Openeye Name: 2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-sulfamoylphenyl)propanamide CAS Name: 2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-(3-sulfamoylphenyl)propanamide IUPAC Name: 2-[[5-(4-methylphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-(3-sulfamoylphenyl)propanamide Traditional Name: 2-[[5-(p-tolyl)-1H-1,2,4-triazol-3-yl]thio]-N-(3-sulfamoylphenyl)propionamide Formula: C18H19N5O3S2 MolecularWeight: 417.50516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N

Isomeric SMILES

CC1=CC=C(C=C1)C2=NC(=NN2)SC(C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C18H19N5O3S2/c1-11-6-8-13(9-7-11)16-21-18(23-22-16)27-12(2)17(24)20-14-4-3-5-15(10-14)28(19,25)26/h3-10,12H,1-2H3,(H,20,24)(H2,19,25,26)(H,21,22,23)