Vitas-M small molecule compound
(12aS)-6-(4-bromophenyl)-2-(2-methoxyethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536710
SMILES COCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2ccc(cc2)Br)[nH]c2c1cccc2
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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 C23H22BrN3O3 MW 468.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H22BrN3O3/c1-30-11-10-26-13-20(28)27-19(23(26)29)12-17-16-4-2-3-5-18(16)25-21(17)22(27)14-6-8-15(24)9-7-14/h2-9,19,22,25H,10-13H2,1H3/t19-,22?/m0/s1InChIKey
PMNCMCFUFDBIAD-YDNXMHBPSA-NSynonyms
956932-91-5(12aS)6(4bromophenyl)2(2methoxyethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(4bromophenyl)2(2methoxyethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(4bromophenyl)6(2methoxyethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400523
956932915
COCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)Br)(nH)c2c1cccc2
InChI=1SC23H22BrN3O3c1301110261320(28)2719(23(26)29)121716423518(16)2521(17)22(27)146815(24)9714h29192225H1013H21H3t1922?m0s1
MFCD05671571
ZINC000002110842
ZINC000002110844
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