Vitas-M small molecule compound
ethyl (2Z)-5-(4-fluorophenyl)-7-methyl-2-[5-nitro-2-(pyrrolidin-1-yl)benzylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506641
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)F)c(=O)/c(=C/c1cc(ccc1N1CCCC1)[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 C27H25FN4O5S MW 536.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25FN4O5S/c1-3-37-26(34)23-16(2)29-27-31(24(23)17-6-8-19(28)9-7-17)25(33)22(38-27)15-18-14-20(32(35)36)10-11-21(18)30-12-4-5-13-30/h6-11,14-15,24H,3-5,12-13H2,1-2H3/b22-15-InChIKey
FVQGZHIEZXIJEK-JCMHNJIXSA-NSynonyms
6301232
ethyl(2~(Z))5(4fluorophenyl)7methyl2((5nitro2pyrrolidin1ylphenyl)methylidene)3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)5(4fluorophenyl)7methyl2(5nitro2(pyrrolidin1yl)benzylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC27H25FN4O5Sc133726(34)2316(2)292731(24(23)176819(28)9717)25(33)22(3827)15181420(32(35)36)101121(18)3012451330h611141524H351213H212H3b2215
MFCD31614375
ZINC000103708376
ZINC000103708382
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