Vitas-M small molecule compound
ethyl (2E)-2-[3-methoxy-4-(3-methylbutoxy)benzylidene]-5-(4-methoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK797819
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1ccc(c(c1)OC)OCCC(C)C)/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 C30H34N2O6S MW 550.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O6S/c1-7-37-29(34)26-19(4)31-30-32(27(26)21-9-11-22(35-5)12-10-21)28(33)25(39-30)17-20-8-13-23(24(16-20)36-6)38-15-14-18(2)3/h8-13,16-18,27H,7,14-15H2,1-6H3/b25-17+InChIKey
OWKDIFIXUUZUCI-KOEQRZSOSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1ccc(c(c1)OC)OCCC(C)C)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)OC)C(=O)C(=CC4=CC(=C(C=C4)OCCC(C)C)OC)S2)C
ethyl(2E)2((3methoxy4(3methylbutoxy)phenyl)methylidene)5(4methoxyphenyl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(3methoxy4(3methylbutoxy)benzylidene)5(4methoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC30H34N2O6Sc173729(34)2619(4)313032(27(26)2191122(355)121021)28(33)25(3930)172081323(24(1620)366)38151418(2)3h813161827H71415H216H3b2517+
MFCD03417183
ZINC000100837932
ZINC000100837933
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