Vitas-M small molecule compound
ethyl (2Z)-5-[3-ethoxy-4-(prop-2-en-1-yloxy)phenyl]-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK392866
SMILES C=CCOc1ccc(cc1OCC)C1C(=C(C)N=c2n1c(=O)/c(=C/c1ccco1)/s2)C(=O)OCC
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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 C26H26N2O6S MW 494.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H26N2O6S/c1-5-12-34-19-11-10-17(14-20(19)31-6-2)23-22(25(30)32-7-3)16(4)27-26-28(23)24(29)21(35-26)15-18-9-8-13-33-18/h5,8-11,13-15,23H,1,6-7,12H2,2-4H3/b21-15-InChIKey
LKPRUVZNGOKYIA-QNGOZBTKSA-NSynonyms
C=CCOc1ccc(cc1OCC)C1C(=C(C)N=c2n1c(=O)c(=Cc1ccco1)s2)C(=O)OCC
CCOC1=C(C=CC(=C1)C2C(=C(N=C3N2C(=O)C(=CC4=CC=CO4)S3)C)C(=O)OCC)OCC=C
ethyl(2Z)5(3ethoxy4(prop2en1yloxy)phenyl)2(furan2ylmethylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(3ETHOXY4PROP2ENOXYPHENYL)2(FURAN2YLMETHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H26N2O6Sc15123419111017(1420(19)3162)2322(25(30)3273)16(4)272628(23)24(29)21(3526)151898133318h5811131523H16712H224H3b2115
MFCD03167052
ZINC000002121445
ZINC000002121448
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