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

Systemtic Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Openeye Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]tetrahydrofuran-2-one CAS Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-2-oxolanone IUPAC Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]oxolan-2-one Traditional Name: 4-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]tetrahydrofuran-2-one Formula: C13H13N3O2S MolecularWeight: 275.32622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC3CC(=O)OC3

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SC3CC(=O)OC3

InChI

InChI=1S/C13H13N3O2S/c1-9-14-15-13(19-11-7-12(17)18-8-11)16(9)10-5-3-2-4-6-10/h2-6,11H,7-8H2,1H3