Vitas-M small molecule compound

4-oxo-4-[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]-N-[3-(trifluoromethyl)benzyl]butanamide

Catalog ID
STL524789
SMILES O=C(CCC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)NCc1cccc(c1)C(F)(F)F

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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 C23H24F3N3O3 MW 447.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24F3N3O3/c24-23(25,26)18-4-1-3-15(10-18)11-27-20(30)7-8-21(31)28-12-16-9-17(14-28)19-5-2-6-22(32)29(19)13-16/h1-6,10,16-17H,7-9,11-14H2,(H,27,30)/t16-,17+/m1/s1
InChIKey
SIYAFSFQNAMZQK-SJORKVTESA-N
Synonyms
1212379-45-7
1212379457
1794777
4oxo4((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)~(N)((3(trifluoromethyl)phenyl)methyl)butanamide
4oxo4((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)N(3(trifluoromethyl)benzyl)butanamide
4oxo4((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)N(3(trifluoromethyl)benzyl)butanamide
InChI=1SC23H24F3N3O3c2423(2526)1841315(1018)112720(30)7821(31)281216917(1428)1952622(32)29(19)1316h16101617H791114H2(H2730)t1617+m1s1
MFCD01548155
O=C(CCC(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)NCc1cccc(c1)C(F)(F)F
ZINC000002139061
ZINC2139061

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Available files

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