Vitas-M small molecule compound
N-[(11aS)-11-hydroxy-5-oxo-2,3,5,11a-tetrahydro-1H-pyrrolo[2,1-c][1,4]benzodiazepin-7-yl]-2-(4-hydroxyphthalazin-1-yl)acetamide
Catalog ID
STL539805
SMILES O=C(Cc1nnc(c2c1cccc2)O)Nc1ccc2c(c1)C(=O)N1CCC[C@H]1C(=N2)O
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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 C22H19N5O4 MW 417.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H19N5O4/c28-19(11-17-13-4-1-2-5-14(13)20(29)26-25-17)23-12-7-8-16-15(10-12)22(31)27-9-3-6-18(27)21(30)24-16/h1-2,4-5,7-8,10,18H,3,6,9,11H2,(H,23,28)(H,24,30)(H,26,29)/t18-/m0/s1InChIKey
LTALWGRBMNDKBI-SFHVURJKSA-NSynonyms
1574477-53-4~(N)((6~(a)~(S))611dioxo6~(a)789tetrahydro5~(H)pyrrolo(21c)(14)benzodiazepin2yl)2(4oxo3~(H)phthalazin1yl)acetamide
1574477534
71826776
InChI=1SC22H19N5O4c2819(111713412514(13)20(29)262517)2312781615(1012)22(31)2793618(27)21(30)2416h1245781018H36911H2(H2328)(H2430)(H2629)t18m0s1
N((11aS)11hydroxy5oxo23511atetrahydro1Hpyrrolo(21c)(14)benzodiazepin7yl)2(4hydroxyphthalazin1yl)acetamide
ZINC000096114662
ZINC96114662
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