Vitas-M small molecule compound
methyl (2E)-5-(2-chlorophenyl)-7-methyl-3-oxo-2-[(2E)-3-phenylprop-2-en-1-ylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK726550
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C\C=C\c1ccccc1)/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 C24H19ClN2O3S MW 450.95 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O3S/c1-15-20(23(29)30-2)21(17-12-6-7-13-18(17)25)27-22(28)19(31-24(27)26-15)14-8-11-16-9-4-3-5-10-16/h3-14,21H,1-2H3/b11-8+,19-14+InChIKey
IAIVHMVCRMFHIS-SFRRXYARSA-NSynonyms
(E)methyl5(2chlorophenyl)7methyl3oxo2((E)3phenylallylidene)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
CC1=C(C(N2C(=O)C(=CC=CC3=CC=CC=C3)SC2=N1)C4=CC=CC=C4Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=CC=Cc1ccccc1)s2
InChI=1SC24H19ClN2O3Sc11520(23(29)302)21(1712671318(17)25)2722(28)19(3124(27)2615)148111694351016h31421H12H3b118+1914+
methyl(2E)5(2chlorophenyl)7methyl3oxo2((2E)3phenylprop2en1ylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2E)5(2CHLOROPHENYL)7METHYL3OXO2((E)3PHENYLPROP2ENYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL2((2E)3PHENYLPROP2ENYLIDENE)5(2CHLOROPHENYL)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
METHYL5(2CHLOROPHENYL)7METHYL3OXO2(3PHENYL2PROPENYLIDENE)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01458295
ZINC000008441250
ZINC000013370558
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