Vitas-M small molecule compound

(12bS)-9-fluoro-12b-methyl-2-[3-(propan-2-yloxy)propyl]-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione

Catalog ID
STL547823
SMILES CC(OCCCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1CC2)cc(cc3)F)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 C21H26FN3O3 MW 387.45 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26FN3O3/c1-13(2)28-10-4-8-24-12-18(26)25-9-7-15-16-11-14(22)5-6-17(16)23-19(15)21(25,3)20(24)27/h5-6,11,13,23H,4,7-10,12H2,1-3H3/t21-/m0/s1
InChIKey
QNVVXHZGODEIKZ-NRFANRHFSA-N
Synonyms
956782-77-7
(12bS)9fluoro12bmethyl2(3(propan2yloxy)propyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(2~(S))13fluoro2methyl4(3propan2yloxypropyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)11(16)1214tetraene36dione
(S)9fluoro2(3isopropoxypropyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
6570611
956782777
CC(OCCCN1CC(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1CC2)cc(cc3)F)C
InChI=1SC21H26FN3O3c113(2)281048241218(26)259715161114(22)5617(16)2319(15)21(253)20(24)27h56111323H471012H213H3t21m0s1
MFCD05671115
ZINC000004073258
ZINC4073258

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Available files

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