methyl 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]acetate Traditional Name: 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)thio]acetic acid methyl ester Formula: C10H17N3O2S MolecularWeight: 243.32588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN=C(N1CC)SCC(=O)OC

Isomeric SMILES

CCCC1=NN=C(N1CC)SCC(=O)OC

InChI

InChI=1S/C10H17N3O2S/c1-4-6-8-11-12-10(13(8)5-2)16-7-9(14)15-3/h4-7H2,1-3H3