Vitas-M small molecule compound
(5E)-2-(4-fluorophenyl)-5-[3-methoxy-4-(pentyloxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK704581
SMILES CCCCCOc1ccc(cc1OC)/C=c\1/sc2n(c1=O)nc(n2)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 C23H22FN3O3S MW 439.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22FN3O3S/c1-3-4-5-12-30-18-11-6-15(13-19(18)29-2)14-20-22(28)27-23(31-20)25-21(26-27)16-7-9-17(24)10-8-16/h6-11,13-14H,3-5,12H2,1-2H3/b20-14+InChIKey
XEKIRJJXWAOTDV-XSFVSMFZSA-NSynonyms
(5E)2(4FLUOROPHENYL)5((3METHOXY4PENTOXYPHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)2(4fluorophenyl)5(3methoxy4(pentyloxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(Z)2(4fluorophenyl)5(3methoxy4(pentyloxy)benzylidene)thiazolo(32b)(124)triazol6(5H)one
CCCCCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=C(C=C4)F)S2)OC
CCCCCOc1ccc(cc1OC)C=c1sc2n(c1=O)nc(n2)c1ccc(cc1)F
InChI=1SC23H22FN3O3Sc134512301811615(1319(18)292)142022(28)2723(3120)2521(2627)167917(24)10816h6111314H3512H212H3b2014+
MFCD04591364
ZINC000026534015
ZINC26534015
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