Vitas-M small molecule compound
2-amino-1-{[(E)-(4-fluorophenyl)methylidene]amino}-N-[2-(4-methoxyphenyl)ethyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK920667
SMILES COc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(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 C27H23FN6O2 MW 482.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23FN6O2/c1-36-20-12-8-17(9-13-20)14-15-30-27(35)23-24-26(33-22-5-3-2-4-21(22)32-24)34(25(23)29)31-16-18-6-10-19(28)11-7-18/h2-13,16H,14-15,29H2,1H3,(H,30,35)/b31-16+InChIKey
HMBLALFZSKWRLF-WCMJOSRZSA-NSynonyms
835908-76-4(E)2amino1((4fluorobenzylidene)amino)N(4methoxyphenethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2amino1(((E)(4fluorophenyl)methylidene)amino)N(2(4methoxyphenyl)ethyl)1Hpyrrolo(23b)quinoxaline3carboxamide
2AMINO1((E)(4FLUOROPHENYL)METHYLIDENEAMINO)N(2(4METHOXYPHENYL)ETHYL)PYRROLO(32B)QUINOXALINE3CARBOXAMIDE
835908764
COC1=CC=C(C=C1)CCNC(=O)C2=C(N(C3=NC4=CC=CC=C4N=C23)N=CC5=CC=C(C=C5)F)N
COc1ccc(cc1)CCNC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)F
InChI=1SC27H23FN6O2c1362012817(91320)14153027(35)232426(3322532421(22)3224)34(25(23)29)31161861019(28)11718h21316H141529H21H3(H3035)b3116+
MFCD03686925
ZINC000002249203
ZINC33351563
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