N-[4-[3-[4-(2-methylpropyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylsulfamoyl]phenyl]ethanamide

Systemtic Name: N-[4-[3-[4-(2-methylpropyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylsulfamoyl]phenyl]ethanamide Openeye Name: N-[4-[3-(4-isobutyl-5-methylsulfanyl-1,2,4-triazol-3-yl)propylsulfamoyl]phenyl]acetamide CAS Name: N-[4-[3-[4-(2-methylpropyl)-5-(methylthio)-1,2,4-triazol-3-yl]propylsulfamoyl]phenyl]acetamide IUPAC Name: N-[4-[3-[4-(2-methylpropyl)-5-methylsulfanyl-1,2,4-triazol-3-yl]propylsulfamoyl]phenyl]acetamide Traditional Name: N-[4-[3-[4-isobutyl-5-(methylthio)-1,2,4-triazol-3-yl]propylsulfamoyl]phenyl]acetamide Formula: C18H27N5O3S2 MolecularWeight: 425.56868

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SC)CCCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

Isomeric SMILES

CC(C)CN1C(=NN=C1SC)CCCNS(=O)(=O)C2=CC=C(C=C2)NC(=O)C

InChI

InChI=1S/C18H27N5O3S2/c1-13(2)12-23-17(21-22-18(23)27-4)6-5-11-19-28(25,26)16-9-7-15(8-10-16)20-14(3)24/h7-10,13,19H,5-6,11-12H2,1-4H3,(H,20,24)