Vitas-M small molecule compound
(12aS)-2-(butan-2-yl)-6-(4-methoxyphenyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL548934
SMILES COc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)C(CC)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 C25H27N3O3 MW 417.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H27N3O3/c1-4-15(2)27-14-22(29)28-21(25(27)30)13-19-18-7-5-6-8-20(18)26-23(19)24(28)16-9-11-17(31-3)12-10-16/h5-12,15,21,24,26H,4,13-14H2,1-3H3/t15?,21-,24?/m0/s1InChIKey
LWPCIFBETYGOOY-RDNFPUQESA-NSynonyms
956974-87-1(12aS)2(butan2yl)6(4methoxyphenyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)2(secbutyl)6(4methoxyphenyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))6butan2yl2(4methoxyphenyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16400930
956974871
COc1ccc(cc1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)C(CC)C
InChI=1SC25H27N3O3c1415(2)271422(29)2821(25(27)30)131918756820(18)2623(19)24(28)1691117(313)121016h51215212426H41314H213H3t15?2124?m0s1
MFCD05672251
ZINC000002112112
ZINC000002112115
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