Vitas-M small molecule compound
3-[(4-chlorophenoxy)methyl]-4-ethyl-5-{[(2E)-3-phenylprop-2-en-1-yl]sulfanyl}-4H-1,2,4-triazole
Catalog ID
STL052207
SMILES CCn1c(SC/C=C/c2ccccc2)nnc1COc1ccc(cc1)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 C20H20ClN3OS MW 385.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H20ClN3OS/c1-2-24-19(15-25-18-12-10-17(21)11-13-18)22-23-20(24)26-14-6-9-16-7-4-3-5-8-16/h3-13H,2,14-15H2,1H3/b9-6+InChIKey
AVCJQZNLIBWLGA-RMKNXTFCSA-NSynonyms
848922-58-71((5((2E)3PHENYLPROP2ENYLTHIO)4ETHYL(124TRIAZOL3YL))METHOXY)4CHLOROBENZENE
3((4chlorophenoxy)methyl)4ethyl5(((2E)3phenylprop2en1yl)sulfanyl)4H124triazole
3((4CHLOROPHENOXY)METHYL)4ETHYL5((E)3PHENYLPROP2ENYL)SULFANYL124TRIAZOLE
3((4chlorophenoxy)methyl)5(cinnamylthio)4ethyl4H124triazole
3(4CHLOROPHENOXYMETHYL)4ETHYL5(((2E)3PHENYLPROP2EN1YL)SULFANYL)4H124TRIAZOLE
848922587
CCN1C(=NN=C1SCC=CC2=CC=CC=C2)COC3=CC=C(C=C3)Cl
CCn1c(SCC=Cc2ccccc2)nnc1COc1ccc(cc1)Cl
InChI=1SC20H20ClN3OSc122419(152518121017(21)111318)222320(24)261469167435816h313H21415H21H3b96+
MFCD05677584
ZINC000002443002
ZINC02443002
ZINC2443002
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