Vitas-M small molecule compound
(12aS)-6-(2-ethoxyphenyl)-2-(2-phenylethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537077
SMILES CCOc1ccccc1C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)CCc1ccccc1
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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 C30H29N3O3 MW 479.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N3O3/c1-2-36-26-15-9-7-13-22(26)29-28-23(21-12-6-8-14-24(21)31-28)18-25-30(35)32(19-27(34)33(25)29)17-16-20-10-4-3-5-11-20/h3-15,25,29,31H,2,16-19H2,1H3/t25-,29?/m0/s1InChIKey
HRFWDBNLHBTJOZ-GMMLNUAGSA-NSynonyms
956927-62-1(12aS)6(2ethoxyphenyl)2(2phenylethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6(2ethoxyphenyl)2phenethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2(2ethoxyphenyl)6(2phenylethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400133
956927621
CCOc1ccccc1C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)CCc1ccccc1
InChI=1SC30H29N3O3c12362615971322(26)292823(2112681424(21)3128)182530(35)32(1927(34)33(25)29)171620104351120h315252931H21619H21H3t2529?m0s1
MFCD05670895
ZINC000002108703
ZINC000002108705
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