Vitas-M small molecule compound
(2E)-N-{(E)-{[2-(5-chloro-1H-indol-3-yl)ethyl]amino}[(4,6-dimethylpyrimidin-2-yl)amino]methylidene}-3-(4-chlorophenyl)prop-2-enamide
Catalog ID
STK211136
SMILES O=C(/N=C(/Nc1nc(C)cc(n1)C)\NCCc1c[nH]c2c1cc(Cl)cc2)/C=C/c1ccc(cc1)Cl
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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 C26H24Cl2N6O MW 507.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H24Cl2N6O/c1-16-13-17(2)32-26(31-16)34-25(33-24(35)10-5-18-3-6-20(27)7-4-18)29-12-11-19-15-30-23-9-8-21(28)14-22(19)23/h3-10,13-15,30H,11-12H2,1-2H3,(H2,29,31,32,33,34,35)/b10-5+InChIKey
HESRTMSAWDVRDY-BJMVGYQFSA-NSynonyms
(1E4E)1((46DIMETHYLPYRIMIDIN2YL)AMINO)1((2(5CHLOROINDOL3YL)ETHYL)AMINO)5(4CHLOROPHENYL)2AZAPENTA14DIEN3ONE
(2E)N((E)((2(5chloro1Hindol3yl)ethyl)amino)((46dimethylpyrimidin2yl)amino)methylidene)3(4chlorophenyl)prop2enamide
(E)N(N(2(5CHLORO1HINDOL3YL)ETHYL)N(46DIMETHYLPYRIMIDIN2YL)CARBAMIMIDOYL)3(4CHLOROPHENYL)PROP2ENAMIDE
CC1=CC(=NC(=N1)NC(=NCCC2=CNC3=C2C=C(C=C3)Cl)NC(=O)C=CC4=CC=C(C=C4)Cl)C
InChI=1SC26H24Cl2N6Oc1161317(2)3226(3116)3425(3324(35)105183620(27)7418)291211191530239821(28)1422(19)23h310131530H1112H212H3(H2293132333435)b105+
MFCD07157391
O=C(N=C(Nc1nc(C)cc(n1)C)NCCc1c(nH)c2c1cc(Cl)cc2)C=Cc1ccc(cc1)Cl
ZINC000014671551
ZINC14671551
Check stock
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Check stock on Vitas-MAvailable files
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