Vitas-M small molecule compound
(5E)-2-(2,3-dihydro-1,4-benzodioxin-2-yl)-5-[3-methoxy-4-(2-methylpropoxy)benzylidene][1,3]thiazolo[3,2-b][1,2,4]triazol-6(5H)-one
Catalog ID
STK817010
SMILES COc1cc(ccc1OCC(C)C)/C=c\1/sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
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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 C24H23N3O5S MW 465.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H23N3O5S/c1-14(2)12-30-17-9-8-15(10-19(17)29-3)11-21-23(28)27-24(33-21)25-22(26-27)20-13-31-16-6-4-5-7-18(16)32-20/h4-11,14,20H,12-13H2,1-3H3/b21-11+InChIKey
AOMGIWGHJWEDPA-SRZZPIQSSA-NSynonyms
(5E)2(23dihydro14benzodioxin2yl)5(3methoxy4(2methylpropoxy)benzylidene)(13)thiazolo(32b)(124)triazol6(5H)one
(5E)2(23DIHYDRO14BENZODIOXIN3YL)5((3METHOXY4(2METHYLPROPOXY)PHENYL)METHYLIDENE)(13)THIAZOLO(32B)(124)TRIAZOL6ONE
CC(C)COC1=C(C=C(C=C1)C=C2C(=O)N3C(=NC(=N3)C4COC5=CC=CC=C5O4)S2)OC
COc1cc(ccc1OCC(C)C)C=c1sc2n(c1=O)nc(n2)C1COc2c(O1)cccc2
InChI=1SC24H23N3O5Sc114(2)1230179815(1019(17)293)112123(28)2724(3321)2522(2627)20133116645718(16)3220h4111420H1213H213H3b2111+
MFCD04446206
ZINC000002701820
ZINC000016805674
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