Vitas-M small molecule compound
ethyl (2Z)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-3-oxo-2-(4-propoxybenzylidene)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK799133
SMILES CCCOc1ccc(cc1)/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OCC)C
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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 C29H30N2O7S MW 550.63 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H30N2O7S/c1-6-14-37-21-11-8-19(9-12-21)15-24-27(33)31-26(20-10-13-22(38-18(4)32)23(16-20)35-5)25(28(34)36-7-2)17(3)30-29(31)39-24/h8-13,15-16,26H,6-7,14H2,1-5H3/b24-15-InChIKey
BWNYMIWJAVTGHJ-IWIPYMOSSA-NSynonyms
CCCOC1=CC=C(C=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OCC)C4=CC(=C(C=C4)OC(=O)C)OC
CCCOc1ccc(cc1)C=c1sc2=NC(=C(C(n2c1=O)c1ccc(c(c1)OC)OC(=O)C)C(=O)OCC)C
ethyl(2Z)5(4(acetyloxy)3methoxyphenyl)7methyl3oxo2(4propoxybenzylidene)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)5(4ACETYLOXY3METHOXYPHENYL)7METHYL3OXO2((4PROPOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC29H30N2O7Sc1614372111819(91221)152427(33)3126(20101322(3818(4)32)23(1620)355)25(28(34)3672)17(3)3029(31)3924h813151626H6714H215H3b2415
MFCD03462302
ZINC000097946269
ZINC000097946270
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