Vitas-M small molecule compound

1-({4-[(10aS)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]phenyl}carbonyl)-L-proline

Catalog ID
STK596153
SMILES O=C(N1CCC[C@H]1C(=O)O)c1ccc(cc1)N1C(=O)[C@H]2N(C1=O)Cc1c(C2)cccc1

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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 C23H21N3O5 MW 419.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21N3O5/c27-20(24-11-3-6-18(24)22(29)30)14-7-9-17(10-8-14)26-21(28)19-12-15-4-1-2-5-16(15)13-25(19)23(26)31/h1-2,4-5,7-10,18-19H,3,6,11-13H2,(H,29,30)/t18-,19-/m0/s1
InChIKey
VPDNVSYOQLENHM-OALUTQOASA-N
Synonyms
1014003-32-7
(2S)1(4((10aS)13dioxo1010adihydro5Himidazo(15b)isoquinolin2yl)benzoyl)pyrrolidine2carboxylicacid
(S)1(4((S)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)benzoyl)pyrrolidine2carboxylicacid
1((4((10aS)13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)phenyl)carbonyl)Lproline
1014003327
C1CC(N(C1)C(=O)C2=CC=C(C=C2)N3C(=O)C4CC5=CC=CC=C5CN4C3=O)C(=O)O
InChI=1SC23H21N3O5c2720(24113618(24)22(29)30)147917(10814)2621(28)191215412516(15)1325(19)23(26)31h12457101819H361113H2(H2930)t1819m0s1
MFCD07638786
O=C(N1CCC(C@H)1C(=O)O)c1ccc(cc1)N1C(=O)(C@H)2N(C1=O)Cc1c(C2)cccc1
ZINC000013577020
ZINC13577020

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Available files

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