Vitas-M small molecule compound
ethyl (2Z)-2-(5-bromo-2-hydroxybenzylidene)-7-methyl-3-oxo-5-(2-propoxyphenyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK125958
SMILES CCCOc1ccccc1C1C(=C(C)N=c2n1c(=O)/c(=C/c1cc(Br)ccc1O)/s2)C(=O)OCC
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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 C26H25BrN2O5S MW 557.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H25BrN2O5S/c1-4-12-34-20-9-7-6-8-18(20)23-22(25(32)33-5-2)15(3)28-26-29(23)24(31)21(35-26)14-16-13-17(27)10-11-19(16)30/h6-11,13-14,23,30H,4-5,12H2,1-3H3/b21-14-InChIKey
AXBHPJHCWHZPHZ-STZFKDTASA-NSynonyms
CCCOC1=CC=CC=C1C2C(=C(N=C3N2C(=O)C(=CC4=C(C=CC(=C4)Br)O)S3)C)C(=O)OCC
CCCOc1ccccc1C1C(=C(C)N=c2n1c(=O)c(=Cc1cc(Br)ccc1O)s2)C(=O)OCC
ETHYL(2Z)2((5BROMO2HYDROXYPHENYL)METHYLIDENE)7METHYL3OXO5(2PROPOXYPHENYL)5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ETHYL(2Z)2(5BROMO2HYDROXYBENZYLIDENE)7METHYL3OXO5(2PROPOXYPHENYL)23DIHYDRO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
InChI=1SC26H25BrN2O5Sc14123420976818(20)2322(25(32)3352)15(3)282629(23)24(31)21(3526)14161317(27)101119(16)30h61113142330H4512H213H3b2114
MFCD04398608
ZINC000097959759
ZINC000097959760
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