Vitas-M small molecule compound
prop-2-en-1-yl (2Z)-5-[4-(acetyloxy)phenyl]-2-{[5-(2,5-dichlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK793744
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)/c(=C/c1ccc(o1)c1cc(Cl)ccc1Cl)/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 C30H22Cl2N2O6S MW 609.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H22Cl2N2O6S/c1-4-13-38-29(37)26-16(2)33-30-34(27(26)18-5-8-20(9-6-18)39-17(3)35)28(36)25(41-30)15-21-10-12-24(40-21)22-14-19(31)7-11-23(22)32/h4-12,14-15,27H,1,13H2,2-3H3/b25-15-InChIKey
HLQZWHSSYMJXQK-MYYYXRDXSA-NSynonyms
(Z)allyl5(4acetoxyphenyl)2((5(25dichlorophenyl)furan2yl)methylene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
4(2((5(25DICHLOROPHENYL)(2FURYL))METHYLENE)7METHYL3OXO6(PROP2ENYLOXYCARBONYL)45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDIN5YL)PHENYLACETATE
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)C)c(=O)c(=Cc1ccc(o1)c1cc(Cl)ccc1Cl)s2
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=C(C=CC(=C4)Cl)Cl)SC2=N1)C5=CC=C(C=C5)OC(=O)C)C(=O)OCC=C
InChI=1SC30H22Cl2N2O6Sc14133829(37)2616(2)333034(27(26)185820(9618)3917(3)35)28(36)25(4130)1521101224(4021)221419(31)71123(22)32h412141527H113H223H3b2515
MFCD02993909
prop2en1yl(2Z)5(4(acetyloxy)phenyl)2((5(25dichlorophenyl)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
PROP2ENYL(2Z)5(4ACETYLOXYPHENYL)2((5(25DICHLOROPHENYL)FURAN2YL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ZINC000097947669
ZINC000097947670
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