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

Systemtic Name: N-[4-(4-methyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)phenyl]methanesulfonamide Openeye Name: N-[4-(5-isopropylsulfanyl-4-methyl-1,2,4-triazol-3-yl)phenyl]methanesulfonamide CAS Name: N-[4-[4-methyl-5-(propan-2-ylthio)-1,2,4-triazol-3-yl]phenyl]methanesulfonamide IUPAC Name: N-[4-(4-methyl-5-propan-2-ylsulfanyl-1,2,4-triazol-3-yl)phenyl]methanesulfonamide Traditional Name: N-[4-[5-(isopropylthio)-4-methyl-1,2,4-triazol-3-yl]phenyl]methanesulfonamide Formula: C13H18N4O2S2 MolecularWeight: 326.43762

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)SC1=NN=C(N1C)C2=CC=C(C=C2)NS(=O)(=O)C

Isomeric SMILES

CC(C)SC1=NN=C(N1C)C2=CC=C(C=C2)NS(=O)(=O)C

InChI

InChI=1S/C13H18N4O2S2/c1-9(2)20-13-15-14-12(17(13)3)10-5-7-11(8-6-10)16-21(4,18)19/h5-9,16H,1-4H3