Vitas-M small molecule compound
ethyl (2Z)-2-(2-hydroxy-3-nitrobenzylidene)-5-(2-methoxyphenyl)-3-oxo-7-propyl-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL505031
SMILES CCOC(=O)C1=C(CCC)N=c2n(C1c1ccccc1OC)c(=O)/c(=C/c1cccc(c1O)[N+](=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 C26H25N3O7S MW 523.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O7S/c1-4-9-17-21(25(32)36-5-2)22(16-11-6-7-13-19(16)35-3)28-24(31)20(37-26(28)27-17)14-15-10-8-12-18(23(15)30)29(33)34/h6-8,10-14,22,30H,4-5,9H2,1-3H3/b20-14-InChIKey
RPYGRNORFIQTQK-ZHZULCJRSA-NSynonyms
129892971
ethyl(2~(Z))2((2hydroxy3nitrophenyl)methylidene)5(2methoxyphenyl)3oxo7propyl5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2(2hydroxy3nitrobenzylidene)5(2methoxyphenyl)3oxo7propyl23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H25N3O7Sc1491721(25(32)3652)22(1611671319(16)353)2824(31)20(3726(28)2717)14151081218(23(15)30)29(33)34h6810142230H459H213H3b2014
MFCD03171027
ZINC000059953078
ZINC000059953080
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