Vitas-M small molecule compound
ethyl (2Z)-2-[2-(cyanomethoxy)benzylidene]-7-methyl-5-(4-methylphenyl)-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STL484912
SMILES N#CCOc1ccccc1/C=c/1\sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C)C(=O)OCC)C
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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 C26H23N3O4S MW 473.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H23N3O4S/c1-4-32-25(31)22-17(3)28-26-29(23(22)18-11-9-16(2)10-12-18)24(30)21(34-26)15-19-7-5-6-8-20(19)33-14-13-27/h5-12,15,23H,4,14H2,1-3H3/b21-15-InChIKey
LSADHLJITTUMEC-QNGOZBTKSA-NSynonyms
CCOC(=O)C1=C(N=C2N(C1C3=CC=C(C=C3)C)C(=O)C(=CC4=CC=CC=C4OCC#N)S2)C
ETHYL(2Z)2((2(CYANOMETHOXY)PHENYL)METHYLIDENE)7METHYL5(4METHYLPHENYL)3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)2(2(cyanomethoxy)benzylidene)7methyl5(4methylphenyl)3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC26H23N3O4Sc143225(31)2217(3)282629(23(22)1811916(2)101218)24(30)21(3426)1519756820(19)33141327h5121523H414H213H3b2115
MFCD05040308
N#CCOc1ccccc1C=c1sc2=NC(=C(C(n2c1=O)c1ccc(cc1)C)C(=O)OCC)C
ZINC000002189297
ZINC000002189299
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