ethyl 4-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanoate

Systemtic Name: ethyl 4-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanoate Openeye Name: ethyl 4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanoate CAS Name: 4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 4-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]butanoate Traditional Name: 4-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]butyric acid ethyl ester Formula: C11H19N3O3S MolecularWeight: 273.35186

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SCCCC(=O)OCC

Isomeric SMILES

CCCN1C(=O)NN=C1SCCCC(=O)OCC

InChI

InChI=1S/C11H19N3O3S/c1-3-7-14-10(16)12-13-11(14)18-8-5-6-9(15)17-4-2/h3-8H2,1-2H3,(H,12,16)