Vitas-M small molecule compound
(12bS)-7-(4-bromophenyl)-2-(2-chloro-6-fluorobenzyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529441
SMILES Brc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)Cc1c(F)cccc1Cl
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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 C28H22BrClFN3O2 MW 566.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H22BrClFN3O2/c1-28-26-25(18-5-2-3-8-23(18)32-26)19(16-9-11-17(29)12-10-16)14-34(28)24(35)15-33(27(28)36)13-20-21(30)6-4-7-22(20)31/h2-12,19,32H,13-15H2,1H3/t19?,28-/m0/s1InChIKey
PIMHKNWCRJNCDR-JEBGQCBNSA-NSynonyms
956961-43-6(12bS)7(4bromophenyl)2(2chloro6fluorobenzyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4bromophenyl)2(2chloro6fluorobenzyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(4bromophenyl)4((2chloro6fluorophenyl)methyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16405121
956961436
Brc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1c(F)cccc1Cl
InChI=1SC28H22BrClFN3O2c1282625(18523823(18)3226)19(1691117(29)121016)1434(28)24(35)1533(27(28)36)132021(30)64722(20)31h2121932H1315H21H3t19?28m0s1
MFCD06769106
ZINC000070701417
ZINC000070701419
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