Vitas-M small molecule compound
(12bS)-7-(2-chlorophenyl)-12b-methyl-2-(3-methylbutyl)-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL540880
SMILES CC(CCN1CC(=O)N2[C@@](C1=O)(C)c1[nH]c3c(c1C(C2)c1ccccc1Cl)cccc3)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 C26H28ClN3O2 MW 449.98 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28ClN3O2/c1-16(2)12-13-29-15-22(31)30-14-19(17-8-4-6-10-20(17)27)23-18-9-5-7-11-21(18)28-24(23)26(30,3)25(29)32/h4-11,16,19,28H,12-15H2,1-3H3/t19?,26-/m0/s1InChIKey
YERCQOBOJFQDQM-SYCQMTRVSA-NSynonyms
956911-39-0(12bS)7(2chlorophenyl)12bmethyl2(3methylbutyl)23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(2chlorophenyl)2isopentyl12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(2chlorophenyl)2methyl4(3methylbutyl)4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16401478
956911390
CC(CCN1CC(=O)N2(C@@)(C1=O)(C)c1(nH)c3c(c1C(C2)c1ccccc1Cl)cccc3)C
InChI=1SC26H28ClN3O2c116(2)1213291522(31)301419(178461020(17)27)23189571121(18)2824(23)26(303)25(29)32h411161928H1215H213H3t19?26m0s1
MFCD05674870
ZINC000008952424
ZINC000012869874
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