Vitas-M small molecule compound
1-[(2E)-5-cyclohexyl-1,3,4-thiadiazol-2(3H)-ylidene]-3-(2-methoxyphenyl)urea
Catalog ID
STL040391
SMILES COc1ccccc1NC(=O)/N=c/1\[nH]nc(s1)C1CCCCC1
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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 C16H20N4O2S MW 332.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H20N4O2S/c1-22-13-10-6-5-9-12(13)17-15(21)18-16-20-19-14(23-16)11-7-3-2-4-8-11/h5-6,9-11H,2-4,7-8H2,1H3,(H2,17,18,20,21)InChIKey
CYAFKCOXKLEBNJ-UHFFFAOYSA-NSynonyms
426236-15-91((2E)5cyclohexyl134thiadiazol2(3H)ylidene)3(2methoxyphenyl)urea
1(5CYCLOHEXYL(134)THIADIAZOL2YL)3(2METHOXYPHENYL)UREA
1(5CYCLOHEXYL134THIADIAZOL2YL)3(2METHOXYPHENYL)UREA
426236159
COC1=CC=CC=C1NC(=O)NC2=NN=C(S2)C3CCCCC3
COc1ccccc1NC(=O)N=c1(nH)nc(s1)C1CCCCC1
InChI=1SC16H20N4O2Sc122131065912(13)1715(21)1816201914(2316)117324811h56911H2478H21H3(H217182021)
MFCD03799075
ZINC000001300731
ZINC01300731
ZINC1300731
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