Vitas-M small molecule compound
(12aS)-6-(4-bromophenyl)-2-(thiophen-2-ylmethyl)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537030
SMILES Brc1ccc(cc1)C1N2C(=O)CN(C(=O)[C@@H]2Cc2c1[nH]c1c2cccc1)Cc1cccs1
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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 C25H20BrN3O2S MW 506.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H20BrN3O2S/c26-16-9-7-15(8-10-16)24-23-19(18-5-1-2-6-20(18)27-23)12-21-25(31)28(14-22(30)29(21)24)13-17-4-3-11-32-17/h1-11,21,24,27H,12-14H2/t21-,24?/m0/s1InChIKey
XSQRSWYKZHAPMK-XEGCMXMBSA-NSynonyms
956940-26-4(12aS)6(4bromophenyl)2(thiophen2ylmethyl)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(12aS)6(4bromophenyl)2(thiophen2ylmethyl)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))2(4bromophenyl)6(thiophen2ylmethyl)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16401405
956940264
Brc1ccc(cc1)C1N2C(=O)CN(C(=O)(C@@H)2Cc2c1(nH)c1c2cccc1)Cc1cccs1
InChI=1SC25H20BrN3O2Sc26169715(81016)242319(18512620(18)2723)122125(31)28(1422(30)29(21)24)131743113217h111212427H1214H2t2124?m0s1
MFCD05674430
ZINC000002118888
ZINC000012869433
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