Vitas-M small molecule compound
1-(6-chloro-1,3-benzothiazol-2-yl)-4-(2,3-dihydro-1,4-benzodioxin-6-ylcarbonyl)-3-hydroxy-5-[4-(prop-2-en-1-yloxy)phenyl]-1,5-dihydro-2H-pyrrol-2-one
Catalog ID
STK820274
SMILES C=CCOc1ccc(cc1)C1N(c2nc3c(s2)cc(cc3)Cl)C(=O)C(=C1C(=O)c1ccc2c(c1)OCCO2)O
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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 C29H21ClN2O6S MW 561.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21ClN2O6S/c1-2-11-36-19-7-3-16(4-8-19)25-24(26(33)17-5-10-21-22(14-17)38-13-12-37-21)27(34)28(35)32(25)29-31-20-9-6-18(30)15-23(20)39-29/h2-10,14-15,25,34H,1,11-13H2InChIKey
BTXOEIXWXPHJRF-UHFFFAOYSA-NSynonyms
1(6chloro13benzothiazol2yl)4(23dihydro14benzodioxin6ylcarbonyl)3hydroxy5(4(prop2en1yloxy)phenyl)15dihydro2Hpyrrol2one
5(4(allyloxy)phenyl)1(6chlorobenzo(d)thiazol2yl)4(23dihydrobenzo(b)(14)dioxine6carbonyl)3hydroxy1Hpyrrol2(5H)one
MFCD04010208
ZINC000053336023
ZINC000053336027
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