Vitas-M small molecule compound
(5E)-5-[(7-hydroxy-2,3-dihydro[1,4]dioxino[2,3-g]quinolin-8-yl)methylidene]-3-(3-methoxyphenyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK636282
SMILES COc1cccc(c1)N1C(=O)S/C(=C/c2cc3cc4OCCOc4cc3nc2O)/C1=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 C22H16N2O6S MW 436.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H16N2O6S/c1-28-15-4-2-3-14(10-15)24-21(26)19(31-22(24)27)9-13-7-12-8-17-18(30-6-5-29-17)11-16(12)23-20(13)25/h2-4,7-11H,5-6H2,1H3,(H,23,25)/b19-9+InChIKey
RHRXDZDOSCDSEY-DJKKODMXSA-NSynonyms
(5E)3(3methoxyphenyl)5((7oxo36dihydro2H(14)dioxino(23g)quinolin8yl)methylidene)13thiazolidine24dione
(5E)5((7hydroxy23dihydro(14)dioxino(23g)quinolin8yl)methylidene)3(3methoxyphenyl)13thiazolidine24dione
COC1=CC=CC(=C1)N2C(=O)C(=CC3=CC4=CC5=C(C=C4NC3=O)OCCO5)SC2=O
COc1cccc(c1)N1C(=O)SC(=Cc2cc3cc4OCCOc4cc3nc2O)C1=O
InChI=1SC22H16N2O6Sc1281542314(1015)2421(26)19(3122(24)27)91371281718(30652917)1116(12)2320(13)25h24711H56H21H3(H2325)b199+
MFCD18161017
ZINC000013727518
ZINC13727518
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