3-[[1-(3,5-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]oxolan-2-one

Systemtic Name: 3-[[1-(3,5-dimethylphenyl)-1,2,3,4-tetrazol-5-yl]sulfanyl]oxolan-2-one Openeye Name: 3-[1-(3,5-dimethylphenyl)tetrazol-5-yl]sulfanyltetrahydrofuran-2-one CAS Name: 3-[[1-(3,5-dimethylphenyl)-5-tetrazolyl]thio]-2-oxolanone IUPAC Name: 3-[1-(3,5-dimethylphenyl)tetrazol-5-yl]sulfanyloxolan-2-one Traditional Name: 3-[[1-(3,5-dimethylphenyl)tetrazol-5-yl]thio]tetrahydrofuran-2-one Formula: C13H14N4O2S MolecularWeight: 290.34086

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)N2C(=NN=N2)SC3CCOC3=O)C

Isomeric SMILES

CC1=CC(=CC(=C1)N2C(=NN=N2)SC3CCOC3=O)C

InChI

InChI=1S/C13H14N4O2S/c1-8-5-9(2)7-10(6-8)17-13(14-15-16-17)20-11-3-4-19-12(11)18/h5-7,11H,3-4H2,1-2H3