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

Systemtic Name: ethyl 2-[[4,5-di(propan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[(4,5-diisopropyl-1,2,4-triazol-3-yl)sulfanyl]acetate CAS Name: 2-[[4,5-di(propan-2-yl)-1,2,4-triazol-3-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4,5-di(propan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetate Traditional Name: 2-[(4,5-diisopropyl-1,2,4-triazol-3-yl)thio]acetic acid ethyl ester Formula: C12H21N3O2S MolecularWeight: 271.37904

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(N1C(C)C)C(C)C

Isomeric SMILES

CCOC(=O)CSC1=NN=C(N1C(C)C)C(C)C

InChI

InChI=1S/C12H21N3O2S/c1-6-17-10(16)7-18-12-14-13-11(8(2)3)15(12)9(4)5/h8-9H,6-7H2,1-5H3