Vitas-M small molecule compound
(12bS)-2-(2-chloro-6-fluorobenzyl)-7-(4-ethylphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL532215
SMILES CCc1ccc(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 C30H27ClFN3O2 MW 516.01 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27ClFN3O2/c1-3-18-11-13-19(14-12-18)21-16-35-26(36)17-34(15-22-23(31)8-6-9-24(22)32)29(37)30(35,2)28-27(21)20-7-4-5-10-25(20)33-28/h4-14,21,33H,3,15-17H2,1-2H3/t21?,30-/m0/s1InChIKey
LXIGWWVOOHKJIN-LOGQOBJBSA-NSynonyms
956813-34-6(12bS)2(2chloro6fluorobenzyl)7(4ethylphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2(2chloro6fluorobenzyl)7(4ethylphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4((2chloro6fluorophenyl)methyl)9(4ethylphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403576
956813346
CCc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)Cc1c(F)cccc1Cl
InChI=1SC30H27ClFN3O2c1318111319(141218)21163526(36)1734(152223(31)86924(22)32)29(37)30(352)2827(21)207451025(20)3328h4142133H31517H212H3t21?30m0s1
MFCD06496086
ZINC000008789911
ZINC000012880774
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