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

Systemtic Name: 5-pentyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one Openeye Name: 5-pentyl-3-[(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]tetrahydrofuran-2-one CAS Name: 5-pentyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-2-oxolanone IUPAC Name: 5-pentyl-3-[(5-sulfanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]oxolan-2-one Traditional Name: 5-amyl-3-[(5-thioxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]tetrahydrofuran-2-one Formula: C12H19N3O2S MolecularWeight: 269.36316

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1CC(C(=O)O1)CC2=NC(=S)NN2

Isomeric SMILES

CCCCCC1CC(C(=O)O1)CC2=NC(=S)NN2

InChI

InChI=1S/C12H19N3O2S/c1-2-3-4-5-9-6-8(11(16)17-9)7-10-13-12(18)15-14-10/h8-9H,2-7H2,1H3,(H2,13,14,15,18)