Vitas-M small molecule compound
methyl (2E)-2-[3-methoxy-4-(2-methylpropoxy)benzylidene]-7-methyl-3-oxo-5-[4-(propan-2-yl)phenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506386
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C\c1ccc(c(c1)OC)OCC(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 C30H34N2O5S MW 534.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N2O5S/c1-17(2)16-37-23-13-8-20(14-24(23)35-6)15-25-28(33)32-27(22-11-9-21(10-12-22)18(3)4)26(29(34)36-7)19(5)31-30(32)38-25/h8-15,17-18,27H,16H2,1-7H3/b25-15+InChIKey
CDNPYNIQKYQUKU-MFKUBSTISA-NSynonyms
21168636
InChI=1SC30H34N2O5Sc117(2)16372313820(1424(23)356)152528(33)3227(2211921(101222)18(3)4)26(29(34)367)19(5)3130(32)3825h815171827H16H217H3b2515+
methyl(2~(E))2((3methoxy4(2methylpropoxy)phenyl)methylidene)7methyl3oxo5(4propan2ylphenyl)5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)2(3methoxy4(2methylpropoxy)benzylidene)7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD04085763
ZINC000105255518
ZINC000105255528
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