Vitas-M small molecule compound

ethyl (2E)-2-[4-(methoxycarbonyl)benzylidene]-7-methyl-3-oxo-5-[(E)-2-phenylethenyl]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK794476
SMILES CCOC(=O)C1=C(C)N=c2n(C1/C=C/c1ccccc1)c(=O)/c(=C\c1ccc(cc1)C(=O)OC)/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 C27H24N2O5S MW 488.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H24N2O5S/c1-4-34-26(32)23-17(2)28-27-29(21(23)15-12-18-8-6-5-7-9-18)24(30)22(35-27)16-19-10-13-20(14-11-19)25(31)33-3/h5-16,21H,4H2,1-3H3/b15-12+,22-16+
InChIKey
FLTJYSLWADXJLU-CEHHTOFISA-N
Synonyms
469879-46-7
(E)ethyl2(4(methoxycarbonyl)benzylidene)7methyl3oxo5((E)styryl)35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
469879467
CCOC(=O)C1=C(C)N=c2n(C1C=Cc1ccccc1)c(=O)c(=Cc1ccc(cc1)C(=O)OC)s2
CCOC(=O)C1=C(N=C2N(C1C=CC3=CC=CC=C3)C(=O)C(=CC4=CC=C(C=C4)C(=O)OC)S2)C
ethyl(2E)2((4methoxycarbonylphenyl)methylidene)7methyl3oxo5((E)2phenylethenyl)5H(13)thiazolo(32a)pyrimidine6carboxylate
ethyl(2E)2(4(methoxycarbonyl)benzylidene)7methyl3oxo5((E)2phenylethenyl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC27H24N2O5Sc143426(32)2317(2)282729(21(23)1512188657918)24(30)22(3527)1619101320(141119)25(31)333h51621H4H213H3b1512+2216+
MFCD03088899
ZINC000008915545
ZINC000008915546

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Available files

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