2-chloranyl-N-methyl-5-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfamoyl]-4-sulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-methyl-5-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfamoyl]-4-sulfanyl-benzamide Openeye Name: 2-chloro-5-[(4-isobutyl-1,2,4-triazol-3-yl)sulfamoyl]-N-methyl-4-sulfanyl-benzamide CAS Name: 2-chloro-4-mercapto-N-methyl-5-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfamoyl]benzamide IUPAC Name: 2-chloro-N-methyl-5-[[4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfamoyl]-4-sulfanylbenzamide Traditional Name: 2-chloro-5-[(4-isobutyl-1,2,4-triazol-3-yl)sulfamoyl]-4-mercapto-N-methyl-benzamide Formula: C14H18ClN5O3S2 MolecularWeight: 403.90742

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC)Cl)S

Isomeric SMILES

CC(C)CN1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)NC)Cl)S

InChI

InChI=1S/C14H18ClN5O3S2/c1-8(2)6-20-7-17-18-14(20)19-25(22,23)12-4-9(13(21)16-3)10(15)5-11(12)24/h4-5,7-8,24H,6H2,1-3H3,(H,16,21)(H,18,19)