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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NNC(=N1)C(C)(C)C

Isomeric SMILES

CCOC(=O)CSC1=NNC(=N1)C(C)(C)C

InChI

InChI=1S/C10H17N3O2S/c1-5-15-7(14)6-16-9-11-8(12-13-9)10(2,3)4/h5-6H2,1-4H3,(H,11,12,13)