Vitas-M small molecule compound
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-7-(4-methoxyphenyl)-2,5-dioxo-1,2,5,6,7,8-hexahydroquinoline-3-carboxamide
Catalog ID
STL191054
SMILES COc1ccc(cc1)C1CC(=O)c2c(C1)[nH]c(=O)c(c2)C(=O)Nc1ccc2c(c1)OCCO2
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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 C25H22N2O6 MW 446.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H22N2O6/c1-31-17-5-2-14(3-6-17)15-10-20-18(21(28)11-15)13-19(25(30)27-20)24(29)26-16-4-7-22-23(12-16)33-9-8-32-22/h2-7,12-13,15H,8-11H2,1H3,(H,26,29)(H,27,30)InChIKey
GUTYFCVLJDMFND-UHFFFAOYSA-NSynonyms
COC1=CC=C(C=C1)C2CC3=C(C=C(C(=O)N3)C(=O)NC4=CC5=C(C=C4)OCCO5)C(=O)C2
COc1ccc(cc1)C1CC(=O)c2c(C1)(nH)c(=O)c(c2)C(=O)Nc1ccc2c(c1)OCCO2
InChI=1SC25H22N2O6c131175214(3617)15102018(21(28)1115)1319(25(30)2720)24(29)2616472223(1216)33983222h27121315H811H21H3(H2629)(H2730)
MFCD22390217
N(23dihydro14benzodioxin6yl)7(4methoxyphenyl)25dioxo125678hexahydroquinoline3carboxamide
N(23dihydro14benzodioxin6yl)7(4methoxyphenyl)25dioxo1678tetrahydroquinoline3carboxamide
ZINC000035506389
ZINC000035506393
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