Vitas-M small molecule compound
5-(5-chloro-2-methoxyphenyl)-4-cyclopropyl-2,4-dihydro-3H-1,2,4-triazole-3-thione
Catalog ID
STK625157
SMILES COc1ccc(cc1c1n[nH]c(=S)n1C1CC1)Cl
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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 C12H12ClN3OS MW 281.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H12ClN3OS/c1-17-10-5-2-7(13)6-9(10)11-14-15-12(18)16(11)8-3-4-8/h2,5-6,8H,3-4H2,1H3,(H,15,18)InChIKey
MQWRXMHNFVHNJO-UHFFFAOYSA-NSynonyms
951953-51-83(5chloro2methoxyphenyl)4cyclopropyl1H124triazole5thione
5(5chloro2methoxyphenyl)4cyclopropyl24dihydro3H124triazole3thione
951953518
COC1=C(C=C(C=C1)Cl)C2=NNC(=S)N2C3CC3
COc1ccc(cc1c1n(nH)c(=S)n1C1CC1)Cl
InChI=1SC12H12ClN3OSc11710527(13)69(10)11141512(18)16(11)8348h2568H34H21H3(H1518)
MFCD18159083
ZINC000013685327
ZINC13685327
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