Vitas-M small molecule compound
(5E)-5-[3-methoxy-4-(3-methylbutoxy)benzylidene]-2-(pyridin-4-yl)[1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK796909
SMILES COc1cc(ccc1OCCC(C)C)/C=c\1/sc2n(c1=O)nc(n2)c1ccncc1
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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 C22H22N4O3S MW 422.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22N4O3S/c1-14(2)8-11-29-17-5-4-15(12-18(17)28-3)13-19-21(27)26-22(30-19)24-20(25-26)16-6-9-23-10-7-16/h4-7,9-10,12-14H,8,11H2,1-3H3/b19-13+InChIKey
WILNVOLENQAHAA-CPNJWEJPSA-NSynonyms
(5E)5((3METHOXY4(3METHYLBUTOXY)PHENYL)METHYLIDENE)2PYRIDIN4YL(13)THIAZOLO(32B)(124)TRIAZOL6ONE
(5E)5(3methoxy4(3methylbutoxy)benzylidene)2(pyridin4yl)(13)thiazolo(32b)(124)triazol6(5H)one
(E)5(4(isopentyloxy)3methoxybenzylidene)2(pyridin4yl)thiazolo(32b)(124)triazol6(5H)one
CC(C)CCOC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4=CC=NC=C4)S2)OC
COc1cc(ccc1OCCC(C)C)C=c1sc2n(c1=O)nc(n2)c1ccncc1
InChI=1SC22H22N4O3Sc114(2)81129175415(1218(17)283)131921(27)2622(3019)2420(2526)16692310716h479101214H811H213H3b1913+
MFCD02985045
ZINC000001018966
ZINC01018966
ZINC1018966
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