Vitas-M small molecule compound

methyl (2E)-5-(4-chlorophenyl)-2-{[5-(2-chlorophenyl)furan-2-yl]methylidene}-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK533185
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)/c(=C\c1ccc(o1)c1ccccc1Cl)/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 C26H18Cl2N2O4S MW 525.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H18Cl2N2O4S/c1-14-22(25(32)33-2)23(15-7-9-16(27)10-8-15)30-24(31)21(35-26(30)29-14)13-17-11-12-20(34-17)18-5-3-4-6-19(18)28/h3-13,23H,1-2H3/b21-13+
InChIKey
BTZCLQCJOYYJPV-FYJGNVAPSA-N
Synonyms
372498-16-3
(E)methyl5(4chlorophenyl)2((5(2chlorophenyl)furan2yl)methylene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
372498163
CC1=C(C(N2C(=O)C(=CC3=CC=C(O3)C4=CC=CC=C4Cl)SC2=N1)C5=CC=C(C=C5)Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)Cl)c(=O)c(=Cc1ccc(o1)c1ccccc1Cl)s2
InChI=1SC26H18Cl2N2O4Sc11422(25(32)332)23(157916(27)10815)3024(31)21(3526(30)2914)1317111220(3417)18534619(18)28h31323H12H3b2113+
methyl(2E)5(4chlorophenyl)2((5(2chlorophenyl)furan2yl)methylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)5(4chlorophenyl)2((5(2chlorophenyl)furan2yl)methylidene)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD01943673
ZINC000100712725
ZINC000100712727

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.