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

Systemtic Name: 5-[(4-butyl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloranyl-4-sulfanyl-benzamide Openeye Name: 5-[(4-butyl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloro-4-sulfanyl-benzamide CAS Name: 5-[(4-butyl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloro-4-mercaptobenzamide IUPAC Name: 5-[(4-butyl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloro-4-sulfanylbenzamide Traditional Name: 5-[(4-butyl-1,2,4-triazol-3-yl)sulfamoyl]-2-chloro-4-mercapto-benzamide Formula: C13H16ClN5O3S2 MolecularWeight: 389.88084

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)N)Cl)S

Isomeric SMILES

CCCCN1C=NN=C1NS(=O)(=O)C2=C(C=C(C(=C2)C(=O)N)Cl)S

InChI

InChI=1S/C13H16ClN5O3S2/c1-2-3-4-19-7-16-17-13(19)18-24(21,22)11-5-8(12(15)20)9(14)6-10(11)23/h5-7,23H,2-4H2,1H3,(H2,15,20)(H,17,18)