Vitas-M small molecule compound
2-amino-1-{[(E)-(3,4-dimethoxyphenyl)methylidene]amino}-N-(4-fluorobenzyl)-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK714494
SMILES COc1cc(ccc1OC)/C=N/n1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccc(cc1)F
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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 C27H23FN6O3 MW 498.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN6O3/c1-36-21-12-9-17(13-22(21)37-2)15-31-34-25(29)23(27(35)30-14-16-7-10-18(28)11-8-16)24-26(34)33-20-6-4-3-5-19(20)32-24/h3-13,15H,14,29H2,1-2H3,(H,30,35)/b31-15+InChIKey
RBZCTDSDNPPHIQ-IBBHUPRXSA-NSynonyms
839699-97-7(E)2amino1((34dimethoxybenzylidene)amino)N(4fluorobenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(34dimethoxyphenyl)methylidene)amino)N(4fluorobenzyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(34DIMETHOXYPHENYL)METHYLIDENEAMINO)N((4FLUOROPHENYL)METHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
839699977
COC1=C(C=C(C=C1)C=NN2C(=C(C3=NC4=CC=CC=C4N=C32)C(=O)NCC5=CC=C(C=C5)F)N)OC
COc1cc(ccc1OC)C=Nn1c2nc3ccccc3nc2c(c1N)C(=O)NCc1ccc(cc1)F
InChI=1SC27H23FN6O3c1362112917(1322(21)372)15313425(29)23(27(35)30141671018(28)11816)2426(34)3320643519(20)3224h31315H1429H212H3(H3035)b3115+
MFCD03692790
ZINC000002254408
ZINC2254407
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