Vitas-M small molecule compound
2-[(4-butyl-8-methyl-2-oxo-2H-chromen-7-yl)oxy]-N-methyl-N-[(1S,9aR)-octahydro-2H-quinolizin-1-ylmethyl]acetamide
Catalog ID
STL548007
SMILES CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)N(C[C@@H]1CCCN2[C@@H]1CCCC2)C
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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 C27H38N2O4 MW 454.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H38N2O4/c1-4-5-9-20-16-26(31)33-27-19(2)24(13-12-22(20)27)32-18-25(30)28(3)17-21-10-8-15-29-14-7-6-11-23(21)29/h12-13,16,21,23H,4-11,14-15,17-18H2,1-3H3/t21-,23+/m0/s1InChIKey
NUOPMSZIIQEWDO-JTHBVZDNSA-NSynonyms
~(N)(((1~(S)9~(a)~(R))23467899~(a)octahydro1~(H)quinolizin1yl)methyl)2(4butyl8methyl2oxochromen7yl)oxy~(N)methylacetamide
110207606
2((4BUTYL8METHYL2OXO2HCHROMEN7YL)OXY)NMETHYLN(((1S9AR)OCTAHYDRO1HQUINOLIZIN1YL)METHYL)ACETAMIDE
2((4butyl8methyl2oxo2Hchromen7yl)oxy)NmethylN((1S9aR)octahydro2Hquinolizin1ylmethyl)acetamide
CCCCc1cc(=O)oc2c1ccc(c2C)OCC(=O)N(C(C@@H)1CCCN2(C@@H)1CCCC2)C
InChI=1SC27H38N2O4c1459201626(31)332719(2)24(131222(20)27)321825(30)28(3)1721108152914761123(21)29h1213162123H41114151718H213H3t2123+m0s1
ZINC000253410824
ZINC253410824
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