Vitas-M small molecule compound

(12bS)-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
STL531931
SMILES CCc1ccc(cc1)C1CN2C(=O)CNC(=O)[C@@]2(c2c1c1ccccc1[nH]2)C

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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 C23H23N3O2 MW 373.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N3O2/c1-3-14-8-10-15(11-9-14)17-13-26-19(27)12-24-22(28)23(26,2)21-20(17)16-6-4-5-7-18(16)25-21/h4-11,17,25H,3,12-13H2,1-2H3,(H,24,28)/t17?,23-/m0/s1
InChIKey
BDOLZUDTDNAFKZ-VXLWULRPSA-N
Synonyms
956815-84-2
(12bS)7(4ethylphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(4ethylphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(4ethylphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402444
956815842
CCc1ccc(cc1)C1CN2C(=O)CNC(=O)(C@@)2(c2c1c1ccccc1(nH)2)C
InChI=1SC23H23N3O2c131481015(11914)17132619(27)122422(28)23(262)2120(17)16645718(16)2521h4111725H31213H212H3(H2428)t17?23m0s1
MFCD06493666
ZINC000004082919
ZINC000004082924

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.