Vitas-M small molecule compound
methyl (2E)-5-[4-(acetyloxy)phenyl]-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK082169
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C\c1ccco1)/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 C22H18N2O6S MW 438.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H18N2O6S/c1-12-18(21(27)28-3)19(14-6-8-15(9-7-14)30-13(2)25)24-20(26)17(31-22(24)23-12)11-16-5-4-10-29-16/h4-11,19H,1-3H3/b17-11+InChIKey
UMYRZFUHCXVESU-GZTJUZNOSA-NSynonyms
312936-88-2(E)methyl5(4acetoxyphenyl)2(furan2ylmethylene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
312936882
4(2(2FURYLMETHYLENE)6(METHOXYCARBONYL)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN5YL)PHENYLACETATE
CC1=C(C(N2C(=O)C(=CC3=CC=CO3)SC2=N1)C4=CC=C(C=C4)OC(=O)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1ccco1)s2
InChI=1SC22H18N2O6Sc11218(21(27)283)19(146815(9714)3013(2)25)2420(26)17(3122(24)2312)111654102916h41119H13H3b1711+
METHYL(2E)5(4(ACETYLOXY)PHENYL)2(FURAN2YLMETHYLIDENE)7METHYL3OXO23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL(2E)5(4ACETYLOXYPHENYL)2(FURAN2YLMETHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD01458892
STK082169
ZINC000006237869
ZINC000012416573
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