Vitas-M small molecule compound
methyl (2Z)-2-({[(4-methyl-2-oxo-2H-chromen-7-yl)oxy]acetyl}imino)-5-(2-methylpropyl)-2,3-dihydro-1,3-thiazole-4-carboxylate
Catalog ID
STL247076
SMILES COC(=O)c1[nH]/c(=N/C(=O)COc2ccc3c(c2)oc(=O)cc3C)/sc1CC(C)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 C21H22N2O6S MW 430.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H22N2O6S/c1-11(2)7-16-19(20(26)27-4)23-21(30-16)22-17(24)10-28-13-5-6-14-12(3)8-18(25)29-15(14)9-13/h5-6,8-9,11H,7,10H2,1-4H3,(H,22,23,24)InChIKey
NFADQHVWSRLXNQ-UHFFFAOYSA-NSynonyms
CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC3=NC(=C(S3)CC(C)C)C(=O)OC
COC(=O)c1(nH)c(=NC(=O)COc2ccc3c(c2)oc(=O)cc3C)sc1CC(C)C
InChI=1SC21H22N2O6Sc111(2)71619(20(26)274)2321(3016)2217(24)102813561412(3)818(25)2915(14)913h568911H710H214H3(H222324)
methyl(2Z)2((((4methyl2oxo2Hchromen7yl)oxy)acetyl)imino)5(2methylpropyl)23dihydro13thiazole4carboxylate
methyl2((2(4methyl2oxochromen7yl)oxyacetyl)amino)5(2methylpropyl)13thiazole4carboxylate
MFCD24860775
ZINC000072401906
ZINC72401906
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