Vitas-M small molecule compound
(5Z)-2-[(E)-2-(4-fluorophenyl)ethenyl]-5-(4-propoxybenzylidene)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK907047
SMILES CCCOc1ccc(cc1)/C=c/1\sc2n(c1=O)nc(n2)/C=C/c1ccc(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 C22H18FN3O2S MW 407.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18FN3O2S/c1-2-13-28-18-10-5-16(6-11-18)14-19-21(27)26-22(29-19)24-20(25-26)12-7-15-3-8-17(23)9-4-15/h3-12,14H,2,13H2,1H3/b12-7+,19-14-InChIKey
HJLPHPHREUBLJP-ZMLBWKPJSA-NSynonyms
(5Z)2((E)2(4fluorophenyl)ethenyl)5((4propoxyphenyl)methylidene)(13)thiazolo(32b)(124)triazol6one
(5Z)2((E)2(4fluorophenyl)ethenyl)5(4propoxybenzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
CCCOC1=CC=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C=CC4=CC=C(C=C4)F)S2
CCCOc1ccc(cc1)C=c1sc2n(c1=O)nc(n2)C=Cc1ccc(cc1)F
InChI=1SC22H18FN3O2Sc1213281810516(61118)141921(27)2622(2919)2420(2526)127153817(23)9415h31214H213H21H3b127+1914
MFCD18076426
ZINC000027023167
ZINC27023167
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