Vitas-M small molecule compound
(12bS)-7-(4-bromophenyl)-2-[2-(2-fluorophenyl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL531703
SMILES Brc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)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 C29H25BrFN3O2 MW 546.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrFN3O2/c1-29-27-26(21-7-3-5-9-24(21)32-27)22(18-10-12-20(30)13-11-18)16-34(29)25(35)17-33(28(29)36)15-14-19-6-2-4-8-23(19)31/h2-13,22,32H,14-17H2,1H3/t22?,29-/m0/s1InChIKey
PFYRUYJSFSPMHV-JKDDQTOVSA-NSynonyms
956966-14-6(12bS)7(4bromophenyl)2(2(2fluorophenyl)ethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4bromophenyl)2(2fluorophenethyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(4bromophenyl)4(2(2fluorophenyl)ethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402938
956966146
Brc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1ccccc1F
InChI=1SC29H25BrFN3O2c1292726(21735924(21)3227)22(18101220(30)131118)1634(29)25(35)1733(28(29)36)151419624823(19)31h2132232H1417H21H3t22?29m0s1
MFCD06494731
ZINC000070697299
ZINC000070697303
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