Vitas-M small molecule compound
N-[(12aS)-6,6-dimethyl-1,4-dioxo-3,4,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indol-2(1H)-yl]cyclohexanecarboxamide
Catalog ID
STL527074
SMILES O=C(C1CCCCC1)NN1CC(=O)N2[C@H](C1=O)Cc1c(C2(C)C)[nH]c2c1cccc2
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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 C23H28N4O3 MW 408.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H28N4O3/c1-23(2)20-16(15-10-6-7-11-17(15)24-20)12-18-22(30)26(13-19(28)27(18)23)25-21(29)14-8-4-3-5-9-14/h6-7,10-11,14,18,24H,3-5,8-9,12-13H2,1-2H3,(H,25,29)/t18-/m0/s1InChIKey
IWZNXUATPAFGBY-SFHVURJKSA-NSynonyms
956192-80-6(S)N(66dimethyl14dioxo341212atetrahydropyrazino(1216)pyrido(34b)indol2(1H6H7H)yl)cyclohexanecarboxamide
~(N)((8~(S))22dimethyl47dioxo3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraen6yl)cyclohexanecarboxamide
1770058
956192806
InChI=1SC23H28N4O3c123(2)2016(1510671117(15)2420)121822(30)26(1319(28)27(18)23)2521(29)148435914h671011141824H35891213H212H3(H2529)t18m0s1
MFCD03267260
N((12aS)66dimethyl14dioxo34671212ahexahydropyrazino(1216)pyrido(34b)indol2(1H)yl)cyclohexanecarboxamide
O=C(C1CCCCC1)NN1CC(=O)N2(C@H)(C1=O)Cc1c(C2(C)C)(nH)c2c1cccc2
ZINC000002115320
ZINC2115320
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