Vitas-M small molecule compound
N-(3-chlorophenyl)-3-[(10aS)-7,8-dimethoxy-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]propanamide
Catalog ID
STK622077
SMILES COc1cc2CN3C(=O)N(C(=O)[C@@H]3Cc2cc1OC)CCC(=O)Nc1cccc(c1)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 C22H22ClN3O5 MW 443.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H22ClN3O5/c1-30-18-9-13-8-17-21(28)25(22(29)26(17)12-14(13)10-19(18)31-2)7-6-20(27)24-16-5-3-4-15(23)11-16/h3-5,9-11,17H,6-8,12H2,1-2H3,(H,24,27)/t17-/m0/s1InChIKey
QIVNIEJURXLOIH-KRWDZBQOSA-NSynonyms
1014408-37-7(S)N(3chlorophenyl)3(78dimethoxy13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)propanamide
1014408377
3((10aS)78dimethoxy13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)N(3chlorophenyl)propanamide
COC1=C(C=C2CN3C(CC2=C1)C(=O)N(C3=O)CCC(=O)NC4=CC(=CC=C4)Cl)OC
COc1cc2CN3C(=O)N(C(=O)(C@@H)3Cc2cc1OC)CCC(=O)Nc1cccc(c1)Cl
InChI=1SC22H22ClN3O5c1301891381721(28)25(22(29)26(17)1214(13)1019(18)312)7620(27)241653415(23)1116h3591117H6812H212H3(H2427)t17m0s1
MFCD09851381
N(3chlorophenyl)3((10aS)78dimethoxy13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)propanamide
ZINC000013689957
ZINC13689957
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