3-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one

Systemtic Name: 3-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]tetrahydrofuran-2-one CAS Name: 3-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-2-oxolanone IUPAC Name: 3-[[4-methyl-5-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]oxolan-2-one Traditional Name: 3-[[4-methyl-5-(o-tolyl)-1,2,4-triazol-3-yl]thio]tetrahydrofuran-2-one Formula: C14H15N3O2S MolecularWeight: 289.3528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NN=C(N2C)SC3CCOC3=O

Isomeric SMILES

CC1=CC=CC=C1C2=NN=C(N2C)SC3CCOC3=O

InChI

InChI=1S/C14H15N3O2S/c1-9-5-3-4-6-10(9)12-15-16-14(17(12)2)20-11-7-8-19-13(11)18/h3-6,11H,7-8H2,1-2H3