1-ethylsulfonyl-3-(furan-2-yl)-5-(phenylmethylsulfanyl)-1,2,4-triazole

Systemtic Name: 1-ethylsulfonyl-3-(furan-2-yl)-5-(phenylmethylsulfanyl)-1,2,4-triazole Openeye Name: 5-benzylsulfanyl-1-ethylsulfonyl-3-(2-furyl)-1,2,4-triazole CAS Name: 1-ethylsulfonyl-3-(2-furanyl)-5-(phenylmethylthio)-1,2,4-triazole IUPAC Name: 5-benzylsulfanyl-1-ethylsulfonyl-3-(furan-2-yl)-1,2,4-triazole Traditional Name: 5-(benzylthio)-1-esyl-3-(2-furyl)-1,2,4-triazole Formula: C15H15N3O3S2 MolecularWeight: 349.4279

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=CO2)SCC3=CC=CC=C3

Isomeric SMILES

CCS(=O)(=O)N1C(=NC(=N1)C2=CC=CO2)SCC3=CC=CC=C3

InChI

InChI=1S/C15H15N3O3S2/c1-2-23(19,20)18-15(22-11-12-7-4-3-5-8-12)16-14(17-18)13-9-6-10-21-13/h3-10H,2,11H2,1H3