N-[4-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide

Systemtic Name: N-[4-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Openeye Name: N-[4-(5-isobutylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]methanesulfonamide CAS Name: N-[4-[4-methyl-5-(2-methylpropylthio)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide IUPAC Name: N-[4-[4-methyl-5-(2-methylpropylsulfanyl)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Traditional Name: N-[4-[5-(isobutylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Formula: C14H20N4O2S2 MolecularWeight: 340.4642

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CSC1=NN=C(N1C)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CC(C)CSC1=NN=C(N1C)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C14H20N4O2S2/c1-10(2)9-21-14-16-15-13(18(14)3)11-5-7-12(8-6-11)17-22(4,19)20/h5-8,10,17H,9H2,1-4H3