Vitas-M small molecule compound
methyl (2E)-2-(2,3-dimethoxybenzylidene)-5-(1,5-dimethyl-1H-pyrazol-4-yl)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL401807
SMILES COC(=O)C1=C(C)N=c2n(C1c1cnn(c1C)C)c(=O)/c(=C\c1cccc(c1OC)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 C23H24N4O5S MW 468.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24N4O5S/c1-12-18(22(29)32-6)19(15-11-24-26(3)13(15)2)27-21(28)17(33-23(27)25-12)10-14-8-7-9-16(30-4)20(14)31-5/h7-11,19H,1-6H3/b17-10+InChIKey
SIMIZECEFXPPGG-LICLKQGHSA-NSynonyms
1005603-34-81005603348
CC1=C(C(N2C(=O)C(=CC3=C(C(=CC=C3)OC)OC)SC2=N1)C4=C(N(N=C4)C)C)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1cnn(c1C)C)c(=O)c(=Cc1cccc(c1OC)OC)s2
InChI=1SC23H24N4O5Sc11218(22(29)326)19(15112426(3)13(15)2)2721(28)17(3323(27)2512)101487916(304)20(14)315h71119H16H3b1710+
methyl(2E)2((23dimethoxyphenyl)methylidene)5(15dimethylpyrazol4yl)7methyl3oxo5H(13)thiazolo(32a)pyrimidine6carboxylate
methyl(2E)2(23dimethoxybenzylidene)5(15dimethyl1Hpyrazol4yl)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
MFCD04045919
ZINC000022704410
ZINC000022704413
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