Vitas-M small molecule compound
(12aS)-2-{[(E)-(2-chlorophenyl)methylidene]amino}-6,6-dimethyl-2,3,6,7,12,12a-hexahydropyrazino[1',2':1,6]pyrido[3,4-b]indole-1,4-dione
Catalog ID
STL537919
SMILES O=C1N(/N=C/c2ccccc2Cl)CC(=O)N2[C@H]1Cc1c3ccccc3[nH]c1C2(C)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 C23H21ClN4O2 MW 420.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H21ClN4O2/c1-23(2)21-16(15-8-4-6-10-18(15)26-21)11-19-22(30)27(13-20(29)28(19)23)25-12-14-7-3-5-9-17(14)24/h3-10,12,19,26H,11,13H2,1-2H3/b25-12+/t19-/m0/s1InChIKey
DCZIKUXBERVFKT-BPDXMKQKSA-NSynonyms
956941-97-2(12aS)2(((E)(2chlorophenyl)methylidene)amino)66dimethyl23671212ahexahydropyrazino(1216)pyrido(34b)indole14dione
(8~(S))6((~(E))(2chlorophenyl)methylideneamino)22dimethyl3617triazatetracyclo(8700^(38)0^(1116))heptadeca1(10)111315tetraene47dione
(SE)2((2chlorobenzylidene)amino)66dimethyl231212atetrahydropyrazino(1216)pyrido(34b)indole14(6H7H)dione
16399475
956941972
InChI=1SC23H21ClN4O2c123(2)2116(158461018(15)2621)111922(30)27(1320(29)28(19)23)251214735917(14)24h310121926H1113H212H3b2512+t19m0s1
MFCD04143887
O=C1N(N=Cc2ccccc2Cl)CC(=O)N2(C@H)1Cc1c3ccccc3(nH)c1C2(C)C
ZINC000002100253
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