Vitas-M small molecule compound
(12bS)-7-(4-bromophenyl)-2-[2-(3-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
STL530588
SMILES Brc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1cccc(c1)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 C29H25BrFN3O2 MW 546.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H25BrFN3O2/c1-29-27-26(22-7-2-3-8-24(22)32-27)23(19-9-11-20(30)12-10-19)16-34(29)25(35)17-33(28(29)36)14-13-18-5-4-6-21(31)15-18/h2-12,15,23,32H,13-14,16-17H2,1H3/t23?,29-/m0/s1InChIKey
DTYGVKSEAULCMT-IZCXSWDTSA-NSynonyms
956999-55-6(12bS)7(4bromophenyl)2(2(3fluorophenyl)ethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4bromophenyl)2(3fluorophenethyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(4bromophenyl)4(2(3fluorophenyl)ethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16401957
956999556
Brc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1cccc(c1)F
InChI=1SC29H25BrFN3O2c1292726(22723824(22)3227)23(1991120(30)121019)1634(29)25(35)1733(28(29)36)14131854621(31)1518h212152332H13141617H21H3t23?29m0s1
MFCD06492586
ZINC000070691968
ZINC000070691970
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