Vitas-M small molecule compound

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

Catalog ID
STL548819
SMILES COCCCN1CC(=O)N2[C@H](C1=O)Cc1c(C2c2cccc(c2)Cl)[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 C24H24ClN3O3 MW 437.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H24ClN3O3/c1-31-11-5-10-27-14-21(29)28-20(24(27)30)13-18-17-8-2-3-9-19(17)26-22(18)23(28)15-6-4-7-16(25)12-15/h2-4,6-9,12,20,23,26H,5,10-11,13-14H2,1H3/t20-,23?/m0/s1
InChIKey
HYNAKTWHUFITMM-AJZOCDQUSA-N
Synonyms
956974-94-0
(12aS)6(3chlorophenyl)2(3methoxypropyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(3chlorophenyl)2(3methoxypropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(3chlorophenyl)6(3methoxypropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401440
956974940
COCCCN1CC(=O)N2(C@H)(C1=O)Cc1c(C2c2cccc(c2)Cl)(nH)c2c1cccc2
InChI=1SC24H24ClN3O3c13111510271421(29)2820(24(27)30)131817823919(17)2622(18)23(28)1564716(25)1215h246912202326H510111314H21H3t2023?m0s1
MFCD05674670
ZINC000002119924
ZINC000002119925

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Available files

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