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

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

CC1CC(C(=O)O1)SC2=NN=CN2C3=CC=CC=C3

Isomeric SMILES

CC1CC(C(=O)O1)SC2=NN=CN2C3=CC=CC=C3

InChI

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