Vitas-M small molecule compound
2-amino-N-(butan-2-yl)-1-{[(E)-(4-chlorophenyl)methylidene]amino}-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide
Catalog ID
STK990844
SMILES CCC(NC(=O)c1c(N)n(c2c1nc1ccccc1n2)/N=C/c1ccc(cc1)Cl)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 C22H21ClN6O MW 420.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21ClN6O/c1-3-13(2)26-22(30)18-19-21(28-17-7-5-4-6-16(17)27-19)29(20(18)24)25-12-14-8-10-15(23)11-9-14/h4-13H,3,24H2,1-2H3,(H,26,30)/b25-12+InChIKey
SVTUXIJCKSMVCC-BRJLIKDPSA-NSynonyms
840508-98-7(E)2aminoN(secbutyl)1((4chlorobenzylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoN(butan2yl)1(((E)(4chlorophenyl)methylidene)amino)1Hpyrrolo(23b)quinoxaline3carboxamide
2aminoNbutan2yl1((E)(4chlorophenyl)methylideneamino)pyrrolo(32b)quinoxaline3carboxamide
840508987
CCC(C)NC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)N=CC4=CC=C(C=C4)Cl)N
CCC(NC(=O)c1c(N)n(c2c1nc1ccccc1n2)N=Cc1ccc(cc1)Cl)C
InChI=1SC22H21ClN6Oc1313(2)2622(30)181921(2817754616(17)2719)29(20(18)24)25121481015(23)11914h413H324H212H3(H2630)b2512+
MFCD04008979
ZINC000005100887
ZINC000005100888
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