Vitas-M small molecule compound

ethyl (2Z)-2-(4-hydroxy-3-nitrobenzylidene)-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STL507131
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1ccc(c(c1)[N+](=O)[O-])O)/s2

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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 C21H17N3O6S2 MW 471.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H17N3O6S2/c1-3-30-20(27)17-11(2)22-21-23(18(17)15-5-4-8-31-15)19(26)16(32-21)10-12-6-7-14(25)13(9-12)24(28)29/h4-10,18,25H,3H2,1-2H3/b16-10-
InChIKey
YSLDMUPZTRZVBC-YBEGLDIGSA-N
Synonyms

6154054
ethyl(2~(Z))2((4hydroxy3nitrophenyl)methylidene)7methyl3oxo5thiophen2yl5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((4HYDROXY3NITROPHENYL)METHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(4hydroxy3nitrobenzylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL2((4HYDROXY3NITROPHENYL)METHYLENE)7METHYL3OXO5(2THIENYL)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC21H17N3O6S2c133020(27)1711(2)222123(18(17)155483115)19(26)16(3221)10126714(25)13(912)24(28)29h4101825H3H212H3b1610
MFCD02316245
ZINC000016682344
ZINC000016682345

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Available files

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