Vitas-M small molecule compound
(12aS)-6-phenyl-2-{[(E)-pyridin-4-ylmethylidene]amino}-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537506
SMILES O=C1N(/N=C/c2ccncc2)CC(=O)N2[C@H]1Cc1c(C2c2ccccc2)[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 C26H21N5O2 MW 435.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H21N5O2/c32-23-16-30(28-15-17-10-12-27-13-11-17)26(33)22-14-20-19-8-4-5-9-21(19)29-24(20)25(31(22)23)18-6-2-1-3-7-18/h1-13,15,22,25,29H,14,16H2/b28-15+/t22-,25?/m0/s1InChIKey
LPMDKAJXZNVCJP-WOCOLYFUSA-NSynonyms
957044-18-7(12aS)6phenyl2(((E)pyridin4ylmethylidene)amino)23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(12aS)6phenyl2((E)(pyridin4ylmethylene)amino)231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
(8~(S))2phenyl6((~(E))pyridin4ylmethylideneamino)3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
16399358
957044187
InChI=1SC26H21N5O2c32231630(281517101227131117)26(33)22142019845921(19)2924(20)25(31(22)23)186213718h11315222529H1416H2b2815+t2225?m0s1
MFCD04143140
O=C1N(N=Cc2ccncc2)CC(=O)N2(C@H)1Cc1c(C2c2ccccc2)(nH)c2c1cccc2
ZINC000002098583
ZINC000002098585
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