dodecyl 2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoate

Systemtic Name: dodecyl 2-(1H-1,2,4-triazol-5-ylsulfanyl)ethanoate Openeye Name: dodecyl 2-(1H-1,2,4-triazol-5-ylsulfanyl)acetate CAS Name: 2-(1H-1,2,4-triazol-5-ylthio)acetic acid dodecyl ester IUPAC Name: dodecyl 2-(1H-1,2,4-triazol-5-ylsulfanyl)acetate Traditional Name: 2-(1H-1,2,4-triazol-5-ylthio)acetic acid lauryl ester Formula: C16H29N3O2S MolecularWeight: 327.48536

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCOC(=O)CSC1=NC=NN1

Isomeric SMILES

CCCCCCCCCCCCOC(=O)CSC1=NC=NN1

InChI

InChI=1S/C16H29N3O2S/c1-2-3-4-5-6-7-8-9-10-11-12-21-15(20)13-22-16-17-14-18-19-16/h14H,2-13H2,1H3,(H,17,18,19)