Vitas-M small molecule compound
ethyl (2E)-7-methyl-3-oxo-5-phenyl-2-(quinoxalin-2-ylmethylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK967722
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)/c(=C\c1cnc3c(n1)cccc3)/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 C25H20N4O3S MW 456.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20N4O3S/c1-3-32-24(31)21-15(2)27-25-29(22(21)16-9-5-4-6-10-16)23(30)20(33-25)13-17-14-26-18-11-7-8-12-19(18)28-17/h4-14,22H,3H2,1-2H3/b20-13+InChIKey
MQXQNWJNRDSWLJ-DEDYPNTBSA-NSynonyms
677768-78-4677768784
CCOC(=O)C1=C(C)N=c2n(C1c1ccccc1)c(=O)c(=Cc1cnc3c(n1)cccc3)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=CC=C3)C(=O)C(=CC4=NC5=CC=CC=C5N=C4)S2)C
ethyl(2E)7methyl3oxo5phenyl2(quinoxalin2ylmethylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)7methyl3oxo5phenyl2(quinoxalin2ylmethylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC25H20N4O3Sc133224(31)2115(2)272529(22(21)1695461016)23(30)20(3325)131714261811781219(18)2817h41422H3H212H3b2013+
MFCD02374155
ZINC000015932127
ZINC000015932129
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