Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-2-(2-chlorobenzylidene)-5-(3,4-dimethoxyphenyl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK533736
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)/c(=C/c1ccccc1Cl)/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 C26H23ClN2O5S MW 511.00 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23ClN2O5S/c1-5-12-34-25(31)22-15(2)28-26-29(23(22)17-10-11-19(32-3)20(13-17)33-4)24(30)21(35-26)14-16-8-6-7-9-18(16)27/h5-11,13-14,23H,1,12H2,2-4H3/b21-14-InChIKey
KENRAGVHNDITRG-STZFKDTASA-NSynonyms
(Z)allyl2(2chlorobenzylidene)5(34dimethoxyphenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(c(c1)OC)OC)c(=O)c(=Cc1ccccc1Cl)s2
CC1=C(C(N2C(=O)C(=CC3=CC=CC=C3Cl)SC2=N1)C4=CC(=C(C=C4)OC)OC)C(=O)OCC=C
InChI=1SC26H23ClN2O5Sc15123425(31)2215(2)282629(23(22)17101119(323)20(1317)334)24(30)21(3526)1416867918(16)27h511131423H112H224H3b2114
MFCD01958065
prop2en1yl(2Z)2(2chlorobenzylidene)5(34dimethoxyphenyl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)2((2CHLOROPHENYL)METHYLIDENE)5(34DIMETHOXYPHENYL)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000009348935
ZINC000009348936
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