3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)oxolan-2-one

Systemtic Name: 3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)oxolan-2-one Openeye Name: 3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)tetrahydrofuran-2-one CAS Name: 3-propyl-5-[(1H-1,2,4-triazol-5-ylthio)methyl]-2-oxolanone IUPAC Name: 3-propyl-5-(1H-1,2,4-triazol-5-ylsulfanylmethyl)oxolan-2-one Traditional Name: 3-propyl-5-[(1H-1,2,4-triazol-5-ylthio)methyl]tetrahydrofuran-2-one Formula: C10H15N3O2S MolecularWeight: 241.31

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CC(OC1=O)CSC2=NC=NN2

Isomeric SMILES

CCCC1CC(OC1=O)CSC2=NC=NN2

InChI

InChI=1S/C10H15N3O2S/c1-2-3-7-4-8(15-9(7)14)5-16-10-11-6-12-13-10/h6-8H,2-5H2,1H3,(H,11,12,13)