Vitas-M small molecule compound
(12aR)-2-(4-fluorobenzyl)-6-[4-(propan-2-yl)phenyl]-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL527751
SMILES Fc1ccc(cc1)CN1CC(=O)N2[C@@H](C1=O)Cc1c(C2c2ccc(cc2)C(C)C)[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 C30H28FN3O2 MW 481.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H28FN3O2/c1-18(2)20-9-11-21(12-10-20)29-28-24(23-5-3-4-6-25(23)32-28)15-26-30(36)33(17-27(35)34(26)29)16-19-7-13-22(31)14-8-19/h3-14,18,26,29,32H,15-17H2,1-2H3/t26-,29?/m1/s1InChIKey
CIIFUZRGTLOEED-QZWVJJBASA-NSynonyms
(12aR)2(4fluorobenzyl)6(4(propan2yl)phenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(4fluorobenzyl)6(4isopropylphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(R))6((4fluorophenyl)methyl)2(4propan2ylphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
135639307
Fc1ccc(cc1)CN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2ccc(cc2)C(C)C)(nH)c2c1cccc2
InChI=1SC30H28FN3O2c118(2)2091121(121020)292824(23534625(23)3228)152630(36)33(1727(35)34(26)29)161971322(31)14819h31418262932H1517H212H3t2629?m1s1
MFCD03661902
ZINC000016042265
ZINC000016042266
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