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

Systemtic Name: methyl 2-[(5-oxidanylidene-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate Openeye Name: methyl 2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate CAS Name: 2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)thio]propanoic acid methyl ester IUPAC Name: methyl 2-[(5-oxo-4-propyl-1H-1,2,4-triazol-3-yl)sulfanyl]propanoate Traditional Name: 2-[(5-keto-4-propyl-1H-1,2,4-triazol-3-yl)thio]propionic acid methyl ester Formula: C9H15N3O3S MolecularWeight: 245.2987

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)NN=C1SC(C)C(=O)OC

Isomeric SMILES

CCCN1C(=O)NN=C1SC(C)C(=O)OC

InChI

InChI=1S/C9H15N3O3S/c1-4-5-12-8(14)10-11-9(12)16-6(2)7(13)15-3/h6H,4-5H2,1-3H3,(H,10,14)