Vitas-M small molecule compound
methyl {6-chloro-8-[(cyclopropylamino)methyl]-7-hydroxy-4-methyl-2-oxo-2H-chromen-3-yl}acetate
Catalog ID
STK614245
SMILES COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2CNC1CC1)O)Cl
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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 C17H18ClNO5 MW 351.79 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18ClNO5/c1-8-10-5-13(18)15(21)12(7-19-9-3-4-9)16(10)24-17(22)11(8)6-14(20)23-2/h5,9,19,21H,3-4,6-7H2,1-2H3InChIKey
XQOFJSJWAZRKKA-UHFFFAOYSA-NSynonyms
CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)CNC3CC3)CC(=O)OC
COC(=O)Cc1c(=O)oc2c(c1C)cc(c(c2CNC1CC1)O)ClCl
InChI=1SC17H18ClNO5c1810513(18)15(21)12(7199349)16(10)2417(22)11(8)614(20)232h591921H3467H212H3
methyl(6chloro8((cyclopropylamino)methyl)7hydroxy4methyl2oxo2Hchromen3yl)acetate
methyl2(6chloro8((cyclopropylamino)methyl)7hydroxy4methyl2oxo2Hchromen3yl)acetatehydrochloride
methyl2(6chloro8((cyclopropylamino)methyl)7hydroxy4methyl2oxochromen3yl)acetate
MFCD08743601
ZINC000020591769
ZINC20591769
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