Vitas-M small molecule compound
(12aS)-6-(2-ethoxyphenyl)-2-[2-(2-fluorophenyl)ethyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536937
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1F
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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 C30H28FN3O3 MW 497.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FN3O3/c1-2-37-26-14-8-5-11-21(26)29-28-22(20-10-4-7-13-24(20)32-28)17-25-30(36)33(18-27(35)34(25)29)16-15-19-9-3-6-12-23(19)31/h3-14,25,29,32H,2,15-18H2,1H3/t25-,29?/m0/s1InChIKey
VIUQFYZRGURDGX-GMMLNUAGSA-NSynonyms
956923-75-4(12aS)6(2ethoxyphenyl)2(2(2fluorophenyl)ethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(2ethoxyphenyl)2(2fluorophenethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(2ethoxyphenyl)6(2(2fluorophenyl)ethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400872
956923754
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCc1ccccc1F
InChI=1SC30H28FN3O3c12372614851121(26)292822(2010471324(20)3228)172530(36)33(1827(35)34(25)29)1615199361223(19)31h314252932H21518H21H3t2529?m0s1
MFCD05672166
ZINC000002111961
ZINC000002111963
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