Vitas-M small molecule compound
N-[2',6'-dihydroxy-3-(2-methoxyphenyl)-4'-oxo-2,3,4,4a-tetrahydro-1H,4'H,6H-spiro[pyrazino[1,2-a]quinoline-5,5'-pyrimidin]-8-yl]propanamide
Catalog ID
STK590349
SMILES CCC(=O)Nc1ccc2c(c1)CC1(C3N2CCN(C3)c2ccccc2OC)C(=NC(=NC1=O)O)O
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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 C25H27N5O5 MW 477.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N5O5/c1-3-21(31)26-16-8-9-17-15(12-16)13-25(22(32)27-24(34)28-23(25)33)20-14-29(10-11-30(17)20)18-6-4-5-7-19(18)35-2/h4-9,12,20H,3,10-11,13-14H2,1-2H3,(H,26,31)(H2,27,28,32,33,34)InChIKey
YDZYEJQDDUFCNM-UHFFFAOYSA-NSynonyms
879478-49-6879478496
CCC(=O)NC1=CC2=C(C=C1)N3CCN(CC3C4(C2)C(=O)NC(=O)NC4=O)C5=CC=CC=C5OC
InChI=1SC25H27N5O5c1321(31)2616891715(1216)1325(22(32)2724(34)2823(25)33)201429(101130(17)20)18645719(18)352h491220H310111314H212H3(H2631)(H22728323334)
MFCD07212819
N(26dihydroxy3(2methoxyphenyl)4oxo2344atetrahydro1H4H6Hspiro(pyrazino(12a)quinoline55pyrimidin)8yl)propanamide
N(3(2methoxyphenyl)246trioxospiro(13diazinane55244a6tetrahydro1Hpyrazino(12a)quinoline)8yl)propanamide
ZINC000018067645
ZINC000018157341
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