Vitas-M small molecule compound
(12aS)-6-(2-ethoxyphenyl)-2-(2-methylpropyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537264
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CC(C)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 C26H29N3O3 MW 431.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29N3O3/c1-4-32-22-12-8-6-10-18(22)25-24-19(17-9-5-7-11-20(17)27-24)13-21-26(31)28(14-16(2)3)15-23(30)29(21)25/h5-12,16,21,25,27H,4,13-15H2,1-3H3/t21-,25?/m0/s1InChIKey
JLUBURQLXZTLBR-BWDMCYIDSA-NSynonyms
956939-03-0(12aS)6(2ethoxyphenyl)2(2methylpropyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(2ethoxyphenyl)2isobutyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(2ethoxyphenyl)6(2methylpropyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400560
956939030
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CC(C)C
InChI=1SC26H29N3O3c14322212861018(22)252419(179571120(17)2724)132126(31)28(1416(2)3)1523(30)29(21)25h51216212527H41315H213H3t2125?m0s1
MFCD05671625
ZINC000002110969
ZINC000002110971
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