Vitas-M small molecule compound
methyl (2E)-5-(4-methoxyphenyl)-7-methyl-2-[(3-methylthiophen-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK799320
SMILES COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)/c(=C\c1sccc1C)/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 C22H20N2O4S2 MW 440.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H20N2O4S2/c1-12-9-10-29-16(12)11-17-20(25)24-19(14-5-7-15(27-3)8-6-14)18(21(26)28-4)13(2)23-22(24)30-17/h5-11,19H,1-4H3/b17-11+InChIKey
WAGXRFCFXGDXIQ-GZTJUZNOSA-NSynonyms
CC1=C(SC=C1)C=C2C(=O)N3C(C(=C(N=C3S2)C)C(=O)OC)C4=CC=C(C=C4)OC
COC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)OC)c(=O)c(=Cc1sccc1C)s2
InChI=1SC22H20N2O4S2c1129102916(12)111720(25)2419(145715(273)8614)18(21(26)284)13(2)2322(24)3017h51119H14H3b1711+
methyl(2E)5(4methoxyphenyl)7methyl2((3methylthiophen2yl)methylidene)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
METHYL(2E)5(4METHOXYPHENYL)7METHYL2((3METHYLTHIOPHEN2YL)METHYLIDENE)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
MFCD03462376
ZINC000000633371
ZINC000000633372
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