Vitas-M small molecule compound
(12bS)-2-cyclopropyl-7-(4-methoxyphenyl)-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529095
SMILES COc1ccc(cc1)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)C1CC1
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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 C25H25N3O3 MW 415.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N3O3/c1-25-23-22(18-5-3-4-6-20(18)26-23)19(15-7-11-17(31-2)12-8-15)13-28(25)21(29)14-27(24(25)30)16-9-10-16/h3-8,11-12,16,19,26H,9-10,13-14H2,1-2H3/t19?,25-/m0/s1InChIKey
QRNKNSHIVHXWFE-BIAFCPFJSA-NSynonyms
956936-38-2(12bS)2cyclopropyl7(4methoxyphenyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)2cyclopropyl7(4methoxyphenyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))4cyclopropyl9(4methoxyphenyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16402915
956936382
COc1ccc(cc1)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)C1CC1
InChI=1SC25H25N3O3c1252322(18534620(18)2623)19(1571117(312)12815)1328(25)21(29)1427(24(25)30)1691016h381112161926H9101314H212H3t19?25m0s1
MFCD06494684
ZINC000004083647
ZINC000004083648
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