Vitas-M small molecule compound
(2S)-2-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-3-phenylpropanoic acid
Catalog ID
STL532789
SMILES OC(=O)[C@@H](N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1)Cc1ccccc1
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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 C20H18N2O4 MW 350.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O4/c23-18-16-11-14-8-4-5-9-15(14)12-21(16)20(26)22(18)17(19(24)25)10-13-6-2-1-3-7-13/h1-9,16-17H,10-12H2,(H,24,25)/t16-,17-/m0/s1InChIKey
ZVMIQRBGSKEZLK-IRXDYDNUSA-NSynonyms
956686-23-0(2~(S))2((10~(a)~(S))13dioxo1010~(a)dihydro5~(H)imidazo(15b)isoquinolin2yl)3phenylpropanoicacid
(2S)2((10aS)13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)3phenylpropanoicacid
(S)2((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)3phenylpropanoicacid
7097275
956686230
InChI=1SC20H18N2O4c2318161114845915(14)1221(16)20(26)22(18)17(19(24)25)10136213713h191617H1012H2(H2425)t1617m0s1
OC(=O)(C@@H)(N1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1)Cc1ccccc1
ZINC000004090514
ZINC4090514
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