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

Systemtic Name: ethyl 2-[(4-ethyl-5-propyl-1,2,4-triazol-3-yl)sulfanyl]ethanoate Openeye Name: ethyl 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 ethyl ester IUPAC Name: ethyl 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 ethyl ester Formula: C11H19N3O2S MolecularWeight: 257.35246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H19N3O2S/c1-4-7-9-12-13-11(14(9)5-2)17-8-10(15)16-6-3/h4-8H2,1-3H3