Vitas-M small molecule compound

methyl (2E)-5-(2-chlorophenyl)-2-(furan-2-ylmethylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

Catalog ID
STK861931
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)/c(=C\c1ccco1)/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 C20H15ClN2O4S MW 414.87 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15ClN2O4S/c1-11-16(19(25)26-2)17(13-7-3-4-8-14(13)21)23-18(24)15(28-20(23)22-11)10-12-6-5-9-27-12/h3-10,17H,1-2H3/b15-10+
InChIKey
QJVJZJVYLMIOOF-XNTDXEJSSA-N
Synonyms
324567-44-4
(E)methyl5(2chlorophenyl)2(furan2ylmethylene)7methyl3oxo35dihydro2Hthiazolo(32a)pyrimidine6carboxylate
324567444
CC1=C(C(N2C(=O)C(=CC3=CC=CO3)SC2=N1)C4=CC=CC=C4Cl)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1ccccc1Cl)c(=O)c(=Cc1ccco1)s2
InChI=1SC20H15ClN2O4Sc11116(19(25)262)17(13734814(13)21)2318(24)15(2820(23)2211)10126592712h31017H12H3b1510+
methyl(2E)5(2chlorophenyl)2(furan2ylmethylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2E)5(2CHLOROPHENYL)2(FURAN2YLMETHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
METHYL5(2CHLOROPHENYL)2(2FURYLMETHYLENE)7METHYL3OXO45DIHYDRO13THIAZOLIDINO(32A)PYRIMIDINE6CARBOXYLATE
METHYL5(2CHLOROPHENYL)2(FURAN2YLMETHYLIDENE)7METHYL3OXO2H3H5HPYRIMIDO(21B)(13)THIAZOLE6CARBOXYLATE
MFCD01794254
ZINC000004807929
ZINC000004807930

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Available files

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