Vitas-M small molecule compound

ethyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-2-[4-(dimethylamino)benzylidene]-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK861768
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)/c(=C\c1ccc(cc1)N(C)C)/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 C28H29N3O6S MW 535.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H29N3O6S/c1-7-36-27(34)24-16(2)29-28-31(25(24)19-10-13-21(37-17(3)32)22(15-19)35-6)26(33)23(38-28)14-18-8-11-20(12-9-18)30(4)5/h8-15,25H,7H2,1-6H3/b23-14+
InChIKey
MLBJQNFFYDSFET-OEAKJJBVSA-N
Synonyms
324564-25-2
(E)ethyl5(4acetoxy3methoxyphenyl)2(4(dimethylamino)benzylidene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
324564252
4(2((4(DIMETHYLAMINO)PHENYL)METHYLENE)6(ETHOXYCARBONYL)7METHYL3OXO(45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN5YL))2METHOXYPHENYLACETATE
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC(=O)C)c(=O)c(=Cc1ccc(cc1)N(C)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC(=O)C)OC)C(=O)C(=CC4=CC=C(C=C4)N(C)C)S2)C
ethyl(2E)5(4(acetyloxy)3methoxyphenyl)2(4(dimethylamino)benzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)5(4acetyloxy3methoxyphenyl)2((4(dimethylamino)phenyl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2E)5(4ACETYLOXY3METHOXYPHENYL)2((4DIMETHYLAMINOPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL5(4(ACETYLOXY)3METHOXYPHENYL)2(4(DIMETHYLAMINO)BENZYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC28H29N3O6Sc173627(34)2416(2)292831(25(24)19101321(3717(3)32)22(1519)356)26(33)23(3828)141881120(12918)30(4)5h81525H7H216H3b2314+
MFCD01162913
ZINC000008425841
ZINC000008425843

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Available files

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