Vitas-M small molecule compound
4-[(10aR)-1,3-dioxo-1,5,10,10a-tetrahydroimidazo[1,5-b]isoquinolin-2(3H)-yl]-N-(2-methoxyethyl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]butanamide
Catalog ID
STL550804
SMILES COCCN(C(=O)CCCN1C(=O)[C@@H]2N(C1=O)Cc1c(C2)cccc1)C[C@@H]1CCCN2[C@@H]1CCCC2
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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 C28H40N4O4 MW 496.65 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H40N4O4/c1-36-17-16-30(19-23-10-6-14-29-13-5-4-11-24(23)29)26(33)12-7-15-31-27(34)25-18-21-8-2-3-9-22(21)20-32(25)28(31)35/h2-3,8-9,23-25H,4-7,10-20H2,1H3/t23-,24+,25+/m0/s1InChIKey
LTBWQNCDQZZQNE-ISJGIBHGSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)4((10~(a)~(R))13dioxo1010~(a)dihydro5~(H)imidazo(15b)isoquinolin2yl)~(N)(2methoxyethyl)butanamide
127253145
4((10aR)13dioxo151010atetrahydroimidazo(15b)isoquinolin2(3H)yl)N(2methoxyethyl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)butanamide
4((R)13dioxo1010adihydroimidazo(15b)isoquinolin2(1H3H5H)yl)N(2methoxyethyl)N(((1S9aR)octahydro1Hquinolizin1yl)methyl)butanamide
COCCN(C(=O)CCCN1C(=O)(C@@H)2N(C1=O)Cc1c(C2)cccc1)C(C@@H)1CCCN2(C@@H)1CCCC2
InChI=1SC28H40N4O4c136171630(1923106142913541124(23)29)26(33)127153127(34)251821823922(21)2032(25)28(31)35h23892325H471020H21H3t2324+25+m0s1
ZINC000604405174
ZINC604405174
Check stock
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