Vitas-M small molecule compound
4-{(E)-[6-(2-chlorobenzyl)-5-methyl-3,7-dioxo-7H-[1,3]thiazolo[3,2-a]pyrimidin-2(3H)-ylidene]methyl}-2-methoxyphenyl acetate
Catalog ID
STK904971
SMILES COc1cc(ccc1OC(=O)C)/C=c\1/sc2n(c1=O)c(C)c(c(=O)n2)Cc1ccccc1Cl
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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 C24H19ClN2O5S MW 482.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClN2O5S/c1-13-17(12-16-6-4-5-7-18(16)25)22(29)26-24-27(13)23(30)21(33-24)11-15-8-9-19(32-14(2)28)20(10-15)31-3/h4-11H,12H2,1-3H3/b21-11+InChIKey
YGZWEPSBBFVOEF-SRZZPIQSSA-NSynonyms
(4((E)(6((2chlorophenyl)methyl)5methyl37dioxo(13)thiazolo(32a)pyrimidin2ylidene)methyl)2methoxyphenyl)acetate
4((E)(6(2chlorobenzyl)5methyl37dioxo7H(13)thiazolo(32a)pyrimidin2(3H)ylidene)methyl)2methoxyphenylacetate
CC1=C(C(=O)N=C2N1C(=O)C(=CC3=CC(=C(C=C3)OC(=O)C)OC)S2)CC4=CC=CC=C4Cl
COc1cc(ccc1OC(=O)C)C=c1sc2n(c1=O)c(C)c(c(=O)n2)Cc1ccccc1Cl
InChI=1SC24H19ClN2O5Sc11317(1216645718(16)25)22(29)262427(13)23(30)21(3324)11158919(3214(2)28)20(1015)313h411H12H213H3b2111+
MFCD18076188
ZINC000027022586
ZINC27022586
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