Vitas-M small molecule compound
(7Z)-3-(1,3-benzodioxol-5-yl)-7-(3,4,5-trimethoxybenzylidene)-3,4-dihydro-2H-[1,3]thiazolo[3,2-a][1,3,5]triazin-6(7H)-one
Catalog ID
STK859905
SMILES COc1cc(cc(c1OC)OC)/C=c/1\sc2=NCN(Cn2c1=O)c1ccc2c(c1)OCO2
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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 C22H21N3O6S MW 455.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21N3O6S/c1-27-17-6-13(7-18(28-2)20(17)29-3)8-19-21(26)25-11-24(10-23-22(25)32-19)14-4-5-15-16(9-14)31-12-30-15/h4-9H,10-12H2,1-3H3/b19-8-InChIKey
KVMBSXLCLJJLHH-UWVJOHFNSA-NSynonyms
690690-30-3(7Z)3(13BENZODIOXOL5YL)7((345TRIMETHOXYPHENYL)METHYLIDENE)24DIHYDRO(13)THIAZOLO(32A)(135)TRIAZIN6ONE
(7Z)3(13benzodioxol5yl)7(345trimethoxybenzylidene)34dihydro2H(13)thiazolo(32a)(135)triazin6(7H)one
(Z)3(benzo(d)(13)dioxol5yl)7(345trimethoxybenzylidene)34dihydro2Hthiazolo(32a)(135)triazin6(7H)one
690690303
COC1=CC(=CC(=C1OC)OC)C=C2C(=O)N3CN(CN=C3S2)C4=CC5=C(C=C4)OCO5
COc1cc(cc(c1OC)OC)C=c1sc2=NCN(Cn2c1=O)c1ccc2c(c1)OCO2
InChI=1SC22H21N3O6Sc12717613(718(282)20(17)293)81921(26)251124(102322(25)3219)14451516(914)31123015h49H1012H213H3b198
MFCD03684180
ZINC000002245762
ZINC02245762
ZINC2245762
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