Vitas-M small molecule compound

methyl 2-(3-amino-1H-1,2,4-triazol-5-yl)cyclohexanecarboxylate

Catalog ID
STL243392
SMILES COC(=O)C1CCCCC1c1[nH]nc(n1)N

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C10H16N4O2 MW 224.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C10H16N4O2/c1-16-9(15)7-5-3-2-4-6(7)8-12-10(11)14-13-8/h6-7H,2-5H2,1H3,(H3,11,12,13,14)
InChIKey
LLTCTUVHEJKVAQ-UHFFFAOYSA-N
Synonyms
1380577-66-1
(1R2S)methyl2(5amino1H124triazol3yl)cyclohexanecarboxylatehydrochloride
1380577661
COC(=O)(C@@H)1CCCC(C@@H)1c1n(nH)c(n1)NCl
COC(=O)C1CCCCC1c1(nH)nc(n1)N
COC(=O)C1CCCCC1C2=NC(=NN2)N
InChI=1SC10H16N4O2c1169(15)753246(7)81210(11)14138h67H25H21H3(H311121314)
methyl2(3amino1H124triazol5yl)cyclohexane1carboxylate
methyl2(3amino1H124triazol5yl)cyclohexanecarboxylate
MFCD24859623
ZINC000061714956
ZINC000085432572

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Available files

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