Vitas-M small molecule compound
ethyl (2Z)-5-(2,4-dichlorophenyl)-7-methyl-3-oxo-2-(pyridin-3-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK981528
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1Cl)Cl)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 C22H17Cl2N3O3S MW 474.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17Cl2N3O3S/c1-3-30-21(29)18-12(2)26-22-27(19(18)15-7-6-14(23)10-16(15)24)20(28)17(31-22)9-13-5-4-8-25-11-13/h4-11,19H,3H2,1-2H3/b17-9-InChIKey
XXHLKBIZTCSBRU-MFOYZWKCSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1Cl)Cl)c(=O)c(=Cc1cccnc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=C(C=C(C=C3)Cl)Cl)C(=O)C(=CC4=CN=CC=C4)S2)C
ethyl(2Z)5(24dichlorophenyl)7methyl3oxo2(pyridin3ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(24DICHLOROPHENYL)7METHYL3OXO2(PYRIDIN3YLMETHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC22H17Cl2N3O3Sc133021(29)1812(2)262227(19(18)157614(23)1016(15)24)20(28)17(3122)913548251113h41119H3H212H3b179
MFCD04615720
ZINC000012564167
ZINC000012564168
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