Vitas-M small molecule compound

diethyl (2Z)-5-amino-2-(4-hydroxy-3-methoxybenzylidene)-7-(4-hydroxy-3-methoxyphenyl)-3-oxo-2,3-dihydro-7H-[1,3]thiazolo[3,2-a]pyridine-6,8-dicarboxylate

Catalog ID
STK729731
SMILES CCOC(=O)C1=c2s/c(=C\c3ccc(c(c3)OC)O)/c(=O)n2C(=C(C1c1ccc(c(c1)OC)O)C(=O)OCC)N

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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 C28H28N2O9S MW 568.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H28N2O9S/c1-5-38-27(34)22-21(15-8-10-17(32)19(13-15)37-4)23(28(35)39-6-2)26-30(24(22)29)25(33)20(40-26)12-14-7-9-16(31)18(11-14)36-3/h7-13,21,31-32H,5-6,29H2,1-4H3/b20-12-
InChIKey
BLWFDBNTGVCNJS-NDENLUEZSA-N
Synonyms

(E)diethyl5amino2(4hydroxy3methoxybenzylidene)7(4hydroxy3methoxyphenyl)3oxo37dihydro2Hthiazolo(32a)pyridine68dicarboxylate
CCOC(=O)C1=C(N2C(=C(C1C3=CC(=C(C=C3)O)OC)C(=O)OCC)SC(=CC4=CC(=C(C=C4)O)OC)C2=O)N
CCOC(=O)C1=c2sc(=Cc3ccc(c(c3)OC)O)c(=O)n2C(=C(C1c1ccc(c(c1)OC)O)C(=O)OCC)N
diethyl(2Z)5amino2(4hydroxy3methoxybenzylidene)7(4hydroxy3methoxyphenyl)3oxo23dihydro7H(13)thiazolo(32a)pyridine68dicarboxylate
DIETHYL(2Z)5AMINO7(4HYDROXY3METHOXYPHENYL)2((4HYDROXY3METHOXYPHENYL)METHYLIDENE)3OXO7H(13)THIAZOLO(32A)PYRIDINE68DICARBOXYLATE
InChI=1SC28H28N2O9Sc153827(34)2221(1581017(32)19(1315)374)23(28(35)3962)2630(24(22)29)25(33)20(4026)12147916(31)18(1114)363h713213132H5629H214H3b2012
MFCD02061552
ZINC000001815600
ZINC000001815602

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Available files

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