Vitas-M small molecule compound
prop-2-en-1-yl (2E)-5-{4-[(furan-2-ylcarbonyl)oxy]phenyl}-7-methyl-3-oxo-2-[4-(prop-2-en-1-yloxy)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK702835
SMILES C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)c1ccco1)c(=O)/c(=C\c1ccc(cc1)OCC=C)/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 C32H26N2O7S MW 582.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H26N2O7S/c1-4-16-38-23-12-8-21(9-13-23)19-26-29(35)34-28(27(31(37)40-17-5-2)20(3)33-32(34)42-26)22-10-14-24(15-11-22)41-30(36)25-7-6-18-39-25/h4-15,18-19,28H,1-2,16-17H2,3H3/b26-19+InChIKey
VIRYCHFELUHYIX-LGUFXXKBSA-NSynonyms
(E)allyl2(4(allyloxy)benzylidene)5(4((furan2carbonyl)oxy)phenyl)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
C=CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC(=O)c1ccco1)c(=O)c(=Cc1ccc(cc1)OCC=C)s2
CC1=C(C(N2C(=O)C(=CC3=CC=C(C=C3)OCC=C)SC2=N1)C4=CC=C(C=C4)OC(=O)C5=CC=CO5)C(=O)OCC=C
InChI=1SC32H26N2O7Sc1416382312821(91323)192629(35)3428(27(31(37)401752)20(3)3332(34)4226)22101424(151122)4130(36)2576183925h415181928H121617H23H3b2619+
MFCD02990710
prop2en1yl(2E)5(4((furan2ylcarbonyl)oxy)phenyl)7methyl3oxo2(4(prop2en1yloxy)benzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
prop2enyl(2E)5(4(furan2carbonyloxy)phenyl)7methyl3oxo2((4prop2enoxyphenyl)methylidene)5H(13)thiazolo(32a)pyrimidine6carboxylate
ZINC000100837516
ZINC000100837518
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