5,5-dimethyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one

Systemtic Name: 5,5-dimethyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one Openeye Name: 5,5-dimethyl-3-[(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]tetrahydrofuran-2-one CAS Name: 5,5-dimethyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-2-oxolanone IUPAC Name: 5,5-dimethyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one Traditional Name: 5,5-dimethyl-3-[(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]tetrahydrofuran-2-one Formula: C9H13N3O2S MolecularWeight: 227.28342

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C(=O)O1)CC2=NC(=S)NN2)C

Isomeric SMILES

CC1(CC(C(=O)O1)CC2=NC(=S)NN2)C

InChI

InChI=1S/C9H13N3O2S/c1-9(2)4-5(7(13)14-9)3-6-10-8(15)12-11-6/h5H,3-4H2,1-2H3,(H2,10,11,12,15)