Vitas-M small molecule compound
(12aS)-2-({(E)-[4-(dimethylamino)phenyl]methylidene}amino)-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL536722
SMILES O=C1N(/N=C/c2ccc(cc2)N(C)C)CC(=O)N2[C@H]1Cc1c(C2)[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 C23H23N5O2 MW 401.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H23N5O2/c1-26(2)16-9-7-15(8-10-16)12-24-28-14-22(29)27-13-20-18(11-21(27)23(28)30)17-5-3-4-6-19(17)25-20/h3-10,12,21,25H,11,13-14H2,1-2H3/b24-12+/t21-/m0/s1InChIKey
CKMKXQLJADMSOB-BZLIYVJTSA-NSynonyms
956964-78-6(12aS)2(((E)(4(dimethylamino)phenyl)methylidene)amino)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((~(E))(4(dimethylamino)phenyl)methylideneamino)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(SE)2((4(dimethylamino)benzylidene)amino)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
9560478
956964786
InChI=1SC23H23N5O2c126(2)169715(81016)1224281422(29)27132018(1121(27)23(28)30)17534619(17)2520h310122125H111314H212H3b2412+t21m0s1
MFCD04142968
O=C1N(N=Cc2ccc(cc2)N(C)C)CC(=O)N2(C@H)1Cc1c(C2)(nH)c2c1cccc2
ZINC000003999841
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