Vitas-M small molecule compound
ethyl (2Z)-2-[3-(benzyloxy)benzylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL484843
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)/c(=C/c1cccc(c1)OCc1ccccc1)/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 C31H28N2O4S MW 524.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H28N2O4S/c1-4-36-30(35)27-21(3)32-31-33(28(27)24-15-13-20(2)14-16-24)29(34)26(38-31)18-23-11-8-12-25(17-23)37-19-22-9-6-5-7-10-22/h5-18,28H,4,19H2,1-3H3/b26-18-InChIKey
ANLWMGAEGSINHW-ITYLOYPMSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc(cc1)C)c(=O)c(=Cc1cccc(c1)OCc1ccccc1)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC(=CC=C4)OCC5=CC=CC=C5)S2)C
ethyl(2Z)2(3(benzyloxy)benzylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
ETHYL(2Z)7METHYL5(4METHYLPHENYL)3OXO2((3PHENYLMETHOXYPHENYL)METHYLIDENE)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC31H28N2O4Sc143630(35)2721(3)323133(28(27)24151320(2)141624)29(34)26(3831)18231181225(1723)37192296571022h51828H419H213H3b2618
MFCD01140721
ZINC000002918416
ZINC000002918418
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