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2-[[5-methyl-4-(3-methylbutyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

2-[[5-methyl-4-(3-methylbutyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate

Systemtic Name:2-[[5-methyl-4-(3-methylbutyl)-1,2,4-triazol-3-yl]sulfanyl]ethanoate
Openeye Name:2-[(4-isopentyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetate
CAS Name:2-[[5-methyl-4-(3-methylbutyl)-1,2,4-triazol-3-yl]thio]acetate
IUPAC Name:2-[[5-methyl-4-(3-methylbutyl)-1,2,4-triazol-3-yl]sulfanyl]acetate
Traditional Name:2-[(4-isoamyl-5-methyl-1,2,4-triazol-3-yl)thio]acetate
Formula: C10H16N3O2S-
MolecularWeight: 242.31794
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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1CCC(C)C)SCC(=O)[O-]


Isomeric SMILES

CC1=NN=C(N1CCC(C)C)SCC(=O)[O-]


InChI

InChI=1S/C10H17N3O2S/c1-7(2)4-5-13-8(3)11-12-10(13)16-6-9(14)15/h7H,4-6H2,1-3H3,(H,14,15)/p-1


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