Vitas-M small molecule compound
11-{[(E)-(3-chlorophenyl)methylidene]amino}-3-(prop-2-en-1-yl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL236767
SMILES C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2/N=C/c1cccc(c1)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 C22H15ClN6O MW 414.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H15ClN6O/c1-2-10-28-13-24-20-18(22(28)30)19-21(27-17-9-4-3-8-16(17)26-19)29(20)25-12-14-6-5-7-15(23)11-14/h2-9,11-13H,1,10H2/b25-12+InChIKey
LVXYAIQLHSQSBJ-BRJLIKDPSA-NSynonyms
860807-94-9(E)3allyl11((3chlorobenzylidene)amino)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(3chlorophenyl)methylidene)amino)3(prop2en1yl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
860807949
C=CCN1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2N=CC5=CC(=CC=C5)Cl
C=CCn1cnc2c(c1=O)c1nc3ccccc3nc1n2N=Cc1cccc(c1)Cl
InChI=1SC22H15ClN6Oc12102813242018(22(28)30)1921(2717943816(17)2619)29(20)25121465715(23)1114h291113H110H2b2512+
MFCD04173820
ZINC000002429144
ZINC33368979
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