Vitas-M small molecule compound
(12bS)-7-(4-chlorophenyl)-2-(2-hydroxyethyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529269
SMILES OCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccc(cc1)Cl)cccc3
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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 C23H22ClN3O3 MW 423.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22ClN3O3/c1-23-21-20(16-4-2-3-5-18(16)25-21)17(14-6-8-15(24)9-7-14)12-27(23)19(29)13-26(10-11-28)22(23)30/h2-9,17,25,28H,10-13H2,1H3/t17?,23-/m0/s1InChIKey
RHVHAUYZNWRNLI-VXLWULRPSA-NSynonyms
956941-12-1(12bS)7(4chlorophenyl)2(2hydroxyethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4chlorophenyl)2(2hydroxyethyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(4chlorophenyl)4(2hydroxyethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16403254
956941121
InChI=1SC23H22ClN3O3c1232120(16423518(16)2521)17(146815(24)9714)1227(23)19(29)1326(101128)22(23)30h29172528H1013H21H3t17?23m0s1
MFCD06495414
OCCN1CC(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1C(C2)c1ccc(cc1)Cl)cccc3
ZINC000008789587
ZINC000008789588
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