octyl 2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanoate

Systemtic Name: octyl 2-(2H-1,2,3-triazol-4-ylsulfanyl)ethanoate Openeye Name: octyl 2-(2H-triazol-4-ylsulfanyl)acetate CAS Name: 2-(2H-triazol-4-ylthio)acetic acid octyl ester IUPAC Name: octyl 2-(2H-triazol-4-ylsulfanyl)acetate Traditional Name: 2-(2H-triazol-4-ylthio)acetic acid octyl ester Formula: C12H21N3O2S MolecularWeight: 271.37904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC(=O)CSC1=NNN=C1

Isomeric SMILES

CCCCCCCCOC(=O)CSC1=NNN=C1

InChI

InChI=1S/C12H21N3O2S/c1-2-3-4-5-6-7-8-17-12(16)10-18-11-9-13-15-14-11/h9H,2-8,10H2,1H3,(H,13,14,15)