Vitas-M small molecule compound
(12bS)-7-(3-ethoxy-4-propoxyphenyl)-2-[2-(2-fluorophenyl)ethyl]-12b-methyl-2,3,6,7,12,12b-hexahydropyrazino[1',2':1,2]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL529411
SMILES CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)[C@@]2(c2c1c1ccccc1[nH]2)C)CCc1ccccc1F
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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 C34H36FN3O4 MW 569.68 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H36FN3O4/c1-4-18-42-28-15-14-23(19-29(28)41-5-2)25-20-38-30(39)21-37(17-16-22-10-6-8-12-26(22)35)33(40)34(38,3)32-31(25)24-11-7-9-13-27(24)36-32/h6-15,19,25,36H,4-5,16-18,20-21H2,1-3H3/t25?,34-/m0/s1InChIKey
JIVOKBFAJGADIY-NCJJPXCVSA-NSynonyms
956824-93-4(12bS)7(3ethoxy4propoxyphenyl)2(2(2fluorophenyl)ethyl)12bmethyl23671212bhexahydropyrazino(1212)pyrido(34b)indole14dione
(12bS)7(3ethoxy4propoxyphenyl)2(2fluorophenethyl)12bmethyl2367tetrahydropyrazino(1212)pyrido(34b)indole14(12H12bH)dione
(2~(S))9(3ethoxy4propoxyphenyl)4(2(2fluorophenyl)ethyl)2methyl4717triazatetracyclo(8700^(27)0^(1116))heptadeca1(10)111315tetraene36dione
16404114
956824934
CCCOc1ccc(cc1OCC)C1CN2C(=O)CN(C(=O)(C@@)2(c2c1c1ccccc1(nH)2)C)CCc1ccccc1F
InChI=1SC34H36FN3O4c14184228151423(1929(28)4152)25203830(39)2137(17162210681226(22)35)33(40)34(383)3231(25)2411791327(24)3632h615192536H4516182021H213H3t25?34m0s1
MFCD06766186
ZINC000070699995
ZINC000070699997
Check stock
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Check stock on Vitas-MAvailable files
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