Vitas-M small molecule compound
(5Z)-5-(2-chloro-6-fluorobenzylidene)-2-[4-(pentyloxy)phenyl][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817479
SMILES CCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)/c(=C/c1c(F)cccc1Cl)/s2
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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 C22H19ClFN3O2S MW 443.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19ClFN3O2S/c1-2-3-4-12-29-15-10-8-14(9-11-15)20-25-22-27(26-20)21(28)19(30-22)13-16-17(23)6-5-7-18(16)24/h5-11,13H,2-4,12H2,1H3/b19-13-InChIKey
VHEYGMRVTXQGRF-UYRXBGFRSA-NSynonyms
(5Z)5((2CHLORO6FLUOROPHENYL)METHYLIDENE)2(4PENTOXYPHENYL)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5Z)5(2chloro6fluorobenzylidene)2(4(pentyloxy)phenyl)(13)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=CC=C(C=C1)C2=NN3C(=O)C(=CC4=C(C=CC=C4Cl)F)SC3=N2
CCCCCOc1ccc(cc1)c1nc2n(n1)c(=O)c(=Cc1c(F)cccc1Cl)s2
InChI=1SC22H19ClFN3O2Sc123412291510814(91115)20252227(2620)21(28)19(3022)131617(23)65718(16)24h51113H2412H21H3b1913
MFCD06308832
ZINC000003649060
ZINC03649060
ZINC3649060
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