Vitas-M small molecule compound
ethyl (2Z)-2-(4-tert-butylbenzylidene)-5-(3,4-diethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL506260
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OCC)OCC)c(=O)/c(=C/c1ccc(cc1)C(C)(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 C31H36N2O5S MW 548.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H36N2O5S/c1-8-36-23-16-13-21(18-24(23)37-9-2)27-26(29(35)38-10-3)19(4)32-30-33(27)28(34)25(39-30)17-20-11-14-22(15-12-20)31(5,6)7/h11-18,27H,8-10H2,1-7H3/b25-17-InChIKey
QCFBUAHJMUFMFU-UQQQWYQISA-NSynonyms
6041859
ethyl(2~(Z))2((4~(tert)butylphenyl)methylidene)5(34diethoxyphenyl)7methyl3oxo5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((4TERTBUTYLPHENYL)METHYLIDENE)5(34DIETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(4tertbutylbenzylidene)5(34diethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC31H36N2O5Sc183623161321(1824(23)3792)2726(29(35)38103)19(4)323033(27)28(34)25(3930)1720111422(151220)31(56)7h111827H810H217H3b2517
MFCD04083565
ZINC000100189724
ZINC000100189727
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