Vitas-M small molecule compound
ethyl (2Z)-2-[(6-chloro-1,3-benzodioxol-5-yl)methylidene]-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
STL506163
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C(C)C)c(=O)/c(=C/c1cc3OCOc3cc1Cl)/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 C27H25ClN2O5S MW 525.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H25ClN2O5S/c1-5-33-26(32)23-15(4)29-27-30(24(23)17-8-6-16(7-9-17)14(2)3)25(31)22(36-27)11-18-10-20-21(12-19(18)28)35-13-34-20/h6-12,14,24H,5,13H2,1-4H3/b22-11-InChIKey
ICAJWFOGNIBEPT-JJFYIABZSA-NSynonyms
6026473
ethyl(2~(Z))2((6chloro13benzodioxol5yl)methylidene)7methyl3oxo5(4propan2ylphenyl)5~(H)(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2Z)2((6chloro13benzodioxol5yl)methylidene)7methyl3oxo5(4(propan2yl)phenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)2((6CHLORO13BENZODIOXOL5YL)METHYLIDENE)7METHYL3OXO5(4PROPAN2YLPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC27H25ClN2O5Sc153326(32)2315(4)292730(24(23)178616(7917)14(2)3)25(31)22(3627)1118102021(1219(18)28)35133420h6121424H513H214H3b2211
MFCD02190086
ZINC000022860451
ZINC000022860453
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