Vitas-M small molecule compound
6-chloro-7-methoxy-4-methyl-3-{2-oxo-2-[4-(pyrimidin-2-yl)piperazin-1-yl]ethyl}-2H-chromen-2-one
Catalog ID
STL237471
SMILES COc1cc2oc(=O)c(c(c2cc1Cl)C)CC(=O)N1CCN(CC1)c1ncccn1
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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 C21H21ClN4O4 MW 428.88 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21ClN4O4/c1-13-14-10-16(22)18(29-2)12-17(14)30-20(28)15(13)11-19(27)25-6-8-26(9-7-25)21-23-4-3-5-24-21/h3-5,10,12H,6-9,11H2,1-2H3InChIKey
DOAGERIHWCOUBH-UHFFFAOYSA-NSynonyms
920427-16-36chloro7methoxy4methyl3(2oxo2(4(pyrimidin2yl)piperazin1yl)ethyl)2Hchromen2one
6chloro7methoxy4methyl3(2oxo2(4pyrimidin2ylpiperazin1yl)ethyl)chromen2one
920427163
CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)N3CCN(CC3)C4=NC=CC=N4
InChI=1SC21H21ClN4O4c113141016(22)18(292)1217(14)3020(28)15(13)1119(27)256826(9725)21234352421h351012H6911H212H3
MFCD08745613
ZINC000009184225
ZINC09184225
ZINC9184225
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