5-phenethylsulfonyl-1H-1,2,4-triazole

Systemtic Name: 5-phenethylsulfonyl-1H-1,2,4-triazole Openeye Name: 5-phenethylsulfonyl-1H-1,2,4-triazole CAS Name: 5-phenethylsulfonyl-1H-1,2,4-triazole IUPAC Name: 5-phenethylsulfonyl-1H-1,2,4-triazole Traditional Name: 5-phenethylsulfonyl-1H-1,2,4-triazole Formula: C10H11N3O2S MolecularWeight: 237.27824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCS(=O)(=O)C2=NC=NN2

Isomeric SMILES

C1=CC=C(C=C1)CCS(=O)(=O)C2=NC=NN2

InChI

InChI=1S/C10H11N3O2S/c14-16(15,10-11-8-12-13-10)7-6-9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H,11,12,13)