Vitas-M small molecule compound
(5E)-5-[(6-hydroxy[1,3]dioxolo[4,5-g]quinolin-7-yl)methylidene]-3-(3-methoxyphenyl)-1,3-thiazolidine-2,4-dione
Catalog ID
STK644251
SMILES COc1cccc(c1)N1C(=O)S/C(=C/c2cc3cc4OCOc4cc3nc2O)/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 C21H14N2O6S MW 422.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14N2O6S/c1-27-14-4-2-3-13(8-14)23-20(25)18(30-21(23)26)7-12-5-11-6-16-17(29-10-28-16)9-15(11)22-19(12)24/h2-9H,10H2,1H3,(H,22,24)/b18-7+InChIKey
KTXKITKAHYEPFV-CNHKJKLMSA-NSynonyms
(5E)3(3methoxyphenyl)5((6oxo5H(13)dioxolo(45g)quinolin7yl)methylidene)13thiazolidine24dione
(5E)5((6hydroxy(13)dioxolo(45g)quinolin7yl)methylidene)3(3methoxyphenyl)13thiazolidine24dione
COC1=CC=CC(=C1)N2C(=O)C(=CC3=CC4=CC5=C(C=C4NC3=O)OCO5)SC2=O
COc1cccc(c1)N1C(=O)SC(=Cc2cc3cc4OCOc4cc3nc2O)C1=O
InChI=1SC21H14N2O6Sc1271442313(814)2320(25)18(3021(23)26)71251161617(29102816)915(11)2219(12)24h29H10H21H3(H2224)b187+
MFCD18163559
ZINC000013690819
ZINC13690819
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