Vitas-M small molecule compound
2-(5,11-dioxo-6a,11-dihydroisoindolo[2,1-a]quinazolin-6(5H)-yl)-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]acetamide
Catalog ID
STL546476
SMILES O=C(CN1C(=O)c2ccccc2N2C1c1ccccc1C2=O)NC[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 C27H30N4O3 MW 458.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H30N4O3/c32-24(28-16-18-8-7-15-29-14-6-5-12-22(18)29)17-30-25-19-9-1-2-10-20(19)27(34)31(25)23-13-4-3-11-21(23)26(30)33/h1-4,9-11,13,18,22,25H,5-8,12,14-17H2,(H,28,32)/t18-,22+,25?/m0/s1InChIKey
KTWVNLGQPOOUFR-HKUCRGJHSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(511dioxo6~(a)~(H)isoindolo(21a)quinazolin6yl)acetamide
110208164
2(511dioxo6a11dihydroisoindolo(21a)quinazolin6(5H)yl)N((1S9aR)octahydro2Hquinolizin1ylmethyl)acetamide
2(511DIOXOISOINDOLO(21A)QUINAZOLIN6(5H6AH11H)YL)N(((1S9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)ACETAMIDE
InChI=1SC27H30N4O3c3224(28161887152914651222(18)29)173025199121020(19)27(34)31(25)2313431121(23)26(30)33h1491113182225H58121417H2(H2832)t1822+25?m0s1
O=C(CN1C(=O)c2ccccc2N2C1c1ccccc1C2=O)NC(C@@H)1CCCN2(C@@H)1CCCC2
ZINC000253408476
ZINC000253408480
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