N-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]ethanesulfonamide

Systemtic Name: N-[3-(phenylmethylsulfanyl)-1H-1,2,4-triazol-5-yl]ethanesulfonamide Openeye Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)ethanesulfonamide CAS Name: N-[3-(phenylmethylthio)-1H-1,2,4-triazol-5-yl]ethanesulfonamide IUPAC Name: N-(3-benzylsulfanyl-1H-1,2,4-triazol-5-yl)ethanesulfonamide Traditional Name: N-[3-(benzylthio)-1H-1,2,4-triazol-5-yl]ethanesulfonamide Formula: C11H14N4O2S2 MolecularWeight: 298.38446

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)NC1=NC(=NN1)SCC2=CC=CC=C2

Isomeric SMILES

CCS(=O)(=O)NC1=NC(=NN1)SCC2=CC=CC=C2

InChI

InChI=1S/C11H14N4O2S2/c1-2-19(16,17)15-10-12-11(14-13-10)18-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3,(H2,12,13,14,15)