Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK534355
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1cccnc1)/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 C25H23N3O5S MW 477.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H23N3O5S/c1-5-11-33-24(30)21-15(2)27-25-28(22(21)17-8-9-18(31-3)19(13-17)32-4)23(29)20(34-25)12-16-7-6-10-26-14-16/h5-10,12-14,22H,1,11H2,2-4H3/b20-12-InChIKey
XYXBCDCYEIMCOW-NDENLUEZSA-NSynonyms
335421-27-7(Z)allyl5(34dimethoxyphenyl)7methyl3oxo2(pyridin3ylmethylene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
335421277
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cccnc1)s2
CC1=C(C(N2C(=O)C(=CC3=CN=CC=C3)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OCC=C
InChI=1SC25H23N3O5Sc15113324(30)2115(2)272528(22(21)178918(313)19(1317)324)23(29)20(3425)12167610261416h510121422H111H224H3b2012
MFCD01953747
prop2en1yl(2Z)5(34dimethoxyphenyl)7methyl3oxo2(pyridin3ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(34DIMETHOXYPHENYL)7METHYL3OXO2(PYRIDIN3YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000006237750
ZINC000006461701
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