Vitas-M small molecule compound
4-[(E)-{[3-(4-fluorophenyl)-5-thioxo-1,5-dihydro-4H-1,2,4-triazol-4-yl]imino}methyl]-2-methoxyphenyl acetate
Catalog ID
STK584753
SMILES COc1cc(ccc1OC(=O)C)/C=N/n1c(=S)[nH]nc1c1ccc(cc1)F
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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 C18H15FN4O3S MW 386.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15FN4O3S/c1-11(24)26-15-8-3-12(9-16(15)25-2)10-20-23-17(21-22-18(23)27)13-4-6-14(19)7-5-13/h3-10H,1-2H3,(H,22,27)/b20-10+InChIKey
LWMRCUPIORNNGU-KEBDBYFISA-NSynonyms
578002-84-3(4((E)(3(4FLUOROPHENYL)5SULFANYLIDENE1H124TRIAZOL4YL)IMINOMETHYL)2METHOXYPHENYL)ACETATE
4((1E)2(5(4FLUOROPHENYL)3SULFANYL(124TRIAZOL4YL))2AZAVINYL)2METHOXYPHENYLACETATE
4((E)((3(4fluorophenyl)5thioxo15dihydro4H124triazol4yl)imino)methyl)2methoxyphenylacetate
578002843
CC(=O)OC1=C(C=C(C=C1)C=NN2C(=NNC2=S)C3=CC=C(C=C3)F)OC
COc1cc(ccc1OC(=O)C)C=Nn1c(=S)(nH)nc1c1ccc(cc1)F
InChI=1SC18H15FN4O3Sc111(24)26158312(916(15)252)10202317(212218(23)27)134614(19)7513h310H12H3(H2227)b2010+
MFCD07205857
ZINC000005668874
ZINC2369255
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