Vitas-M small molecule compound
ethyl (2Z)-5-(3,4-dimethoxyphenyl)-2-(4-hydroxy-3-methoxy-5-nitrobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK377525
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1cc(OC)c(c(c1)[N+](=O)[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 C26H25N3O9S MW 555.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25N3O9S/c1-6-38-25(32)21-13(2)27-26-28(22(21)15-7-8-17(35-3)18(12-15)36-4)24(31)20(39-26)11-14-9-16(29(33)34)23(30)19(10-14)37-5/h7-12,22,30H,6H2,1-5H3/b20-11-InChIKey
ORAQNDMBKYAIHM-JAIQZWGSSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1cc(OC)c(c(c1)(N+)(=O)(O))O)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC(=C(C=C3)OC)OC)C(=O)C(=CC4=CC(=C(C(=C4)OC)O)(N+)(=O)(O))S2)C
ETHYL(2Z)5(34DIMETHOXYPHENYL)2((4HYDROXY3METHOXY5NITROPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(34dimethoxyphenyl)2(4hydroxy3methoxy5nitrobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL5(34DIMETHOXYPHENYL)2((4HYDROXY5METHOXY3NITROPHENYL)METHYLENE)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H25N3O9Sc163825(32)2113(2)272628(22(21)157817(353)18(1215)364)24(31)20(3926)1114916(29(33)34)23(30)19(1014)375h7122230H6H215H3b2011
MFCD01592340
ZINC000004182081
ZINC000004182083
Check stock
See real-time availability and sample size for STK377525 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.