Vitas-M small molecule compound

(12aS)-2-(3-butoxypropyl)-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL527255
SMILES CCCCOCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2(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 C23H31N3O3 MW 397.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H31N3O3/c1-4-5-12-29-13-8-11-25-15-20(27)26-19(22(25)28)14-17-16-9-6-7-10-18(16)24-21(17)23(26,2)3/h6-7,9-10,19,24H,4-5,8,11-15H2,1-3H3/t19-/m0/s1
InChIKey
HCNOLMHCFKASEI-IBGZPJMESA-N
Synonyms
957011-34-6
(12aS)2(3butoxypropyl)66dimethyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6(3butoxypropyl)22dimethyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(S)2(3butoxypropyl)66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
1776382
957011346
CCCCOCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2
InChI=1SC23H31N3O3c145122913811251520(27)2619(22(25)28)1417169671018(16)2421(17)23(262)3h679101924H4581115H213H3t19m0s1
MFCD03267396
ZINC000002121359

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Available files

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