Vitas-M small molecule compound
2-(4-fluorophenoxy)-N-{2,2,2-trichloro-1-[(1R,5S)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]ethyl}acetamide
Catalog ID
STL527475
SMILES O=C(NC(C(Cl)(Cl)Cl)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)COc1ccc(cc1)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 C21H21Cl3FN3O3 MW 488.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H21Cl3FN3O3/c22-21(23,24)20(26-18(29)12-31-16-6-4-15(25)5-7-16)27-9-13-8-14(11-27)17-2-1-3-19(30)28(17)10-13/h1-7,13-14,20H,8-12H2,(H,26,29)/t13-,14+,20?/m0/s1InChIKey
SQHYWYFBTZVUBR-IODPJOFQSA-NSynonyms
956973-54-916398108
2(4fluorophenoxy)~(N)(222trichloro1((1~(R)9~(S))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)ethyl)acetamide
2(4fluorophenoxy)N(222trichloro1((1R5S)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)ethyl)acetamide
2(4fluorophenoxy)N(222trichloro1((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)ethyl)acetamide
956973549
InChI=1SC21H21Cl3FN3O3c2221(2324)20(2618(29)1231166415(25)5716)27913814(1127)1721319(30)28(17)1013h17131420H812H2(H2629)t1314+20?m0s1
MFCD03660418
O=C(NC(C(Cl)(Cl)Cl)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1)COc1ccc(cc1)F
ZINC000020113994
ZINC000020113997
Check stock
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Check stock on Vitas-MAvailable files
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