Vitas-M small molecule compound
ethyl (2Z)-2-(1,3-benzodioxol-5-ylmethylidene)-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
STL506161
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1ccc3c(c1)OCO3)/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 C27H26N2O5S MW 490.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26N2O5S/c1-5-32-26(31)23-16(4)28-27-29(24(23)19-9-7-18(8-10-19)15(2)3)25(30)22(35-27)13-17-6-11-20-21(12-17)34-14-33-20/h6-13,15,24H,5,14H2,1-4H3/b22-13-InChIKey
QLJPVJBAJDUKAZ-XKZIYDEJSA-NSynonyms
5809415
ethyl(2~(Z))2(13benzodioxol5ylmethylidene)7methyl3oxo5(4propan2ylphenyl)5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(13BENZODIOXOL5YLMETHYLENE)5(4ISOPROPYLPHENYL)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(13benzodioxol5ylmethylidene)7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2(13BENZODIOXOL5YLMETHYLIDENE)7METHYL3OXO5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H26N2O5Sc153226(31)2316(4)282729(24(23)199718(81019)15(2)3)25(30)22(3527)13176112021(1217)34143320h6131524H514H214H3b2213
MFCD02312992
ZINC000022748806
ZINC000022748810
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