Vitas-M small molecule compound
ethyl (2Z)-5-(1,3-benzodioxol-5-yl)-2-(4-iodobenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Catalog ID
STK522657
SMILES CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)/c(=C/c1ccc(cc1)I)/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 C24H19IN2O5S MW 574.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19IN2O5S/c1-3-30-23(29)20-13(2)26-24-27(21(20)15-6-9-17-18(11-15)32-12-31-17)22(28)19(33-24)10-14-4-7-16(25)8-5-14/h4-11,21H,3,12H2,1-2H3/b19-10-InChIKey
GQFQLKVNXCMYFV-GRSHGNNSSA-NSynonyms
CCOC(=O)C1=C(C)N=c2n(C1c1ccc3c(c1)OCO3)c(=O)c(=Cc1ccc(cc1)I)s2
CCOC(=O)C1=C(N=C2N(C1C3=CC4=C(C=C3)OCO4)C(=O)C(=CC5=CC=C(C=C5)I)S2)C
ETHYL(2Z)5(13BENZODIOXOL5YL)2((4IODOPHENYL)METHYLIDENE)7METHYL3OXO5H(13)THIAZOLO(32A)PYRIMIDINE6CARBOXYLATE
ethyl(2Z)5(13benzodioxol5yl)2(4iodobenzylidene)7methyl3oxo23dihydro5H(13)thiazolo(32a)pyrimidine6carboxylate
InChI=1SC24H19IN2O5Sc133023(29)2013(2)262427(21(20)15691718(1115)32123117)22(28)19(3324)10144716(25)8514h41121H312H212H3b1910
MFCD01593446
ZINC000002188909
ZINC000002188911
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