Vitas-M small molecule compound
methyl (2Z)-2-{[3-(4-fluorophenyl)-1-phenyl-1H-pyrazol-4-yl]methylidene}-7-methyl-3-oxo-5-(thiophen-2-yl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK798238
SMILES COC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)/c(=C/c1cn(nc1c1ccc(cc1)F)c1ccccc1)/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 C29H21FN4O3S2 MW 556.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H21FN4O3S2/c1-17-24(28(36)37-2)26(22-9-6-14-38-22)34-27(35)23(39-29(34)31-17)15-19-16-33(21-7-4-3-5-8-21)32-25(19)18-10-12-20(30)13-11-18/h3-16,26H,1-2H3/b23-15-InChIKey
OEBARQAYHVIUGV-HAHDFKILSA-NSynonyms
CC1=C(C(N2C(=O)C(=CC3=CN(N=C3C4=CC=C(C=C4)F)C5=CC=CC=C5)SC2=N1)C6=CC=CS6)C(=O)OC
COC(=O)C1=C(C)N=c2n(C1c1cccs1)c(=O)c(=Cc1cn(nc1c1ccc(cc1)F)c1ccccc1)s2
InChI=1SC29H21FN4O3S2c11724(28(36)372)26(2296143822)3427(35)23(3929(34)3117)15191633(217435821)3225(19)18101220(30)131118h31626H12H3b2315
methyl(2Z)2((3(4fluorophenyl)1phenyl1Hpyrazol4yl)methylidene)7methyl3oxo5(thiophen2yl)23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2Z)2((3(4FLUOROPHENYL)1PHENYLPYRAZOL4YL)METHYLIDENE)7METHYL3OXO5THIOPHEN2YL5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03461917
ZINC000002665822
ZINC000002665824
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