Vitas-M small molecule compound
11-{[(E)-(4-chlorophenyl)methylidene]amino}-3-[2-(cyclohex-1-en-1-yl)ethyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL239048
SMILES Clc1ccc(cc1)/C=N/n1c2nc3ccccc3nc2c2c1ncn(c2=O)CCC1=CCCCC1
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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 C27H23ClN6O MW 482.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H23ClN6O/c28-20-12-10-19(11-13-20)16-30-34-25-23(24-26(34)32-22-9-5-4-8-21(22)31-24)27(35)33(17-29-25)15-14-18-6-2-1-3-7-18/h4-6,8-13,16-17H,1-3,7,14-15H2/b30-16+InChIKey
FSZBWOOLQQSDPO-OKCVXOCRSA-NSynonyms
848746-37-2(E)11((4chlorobenzylidene)amino)3(2(cyclohex1en1yl)ethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
11(((E)(4chlorophenyl)methylidene)amino)3(2(cyclohex1en1yl)ethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
848746372
C1CCC(=CC1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=C(C=C6)Cl
Clc1ccc(cc1)C=Nn1c2nc3ccccc3nc2c2c1ncn(c2=O)CCC1=CCCCC1
InChI=1SC27H23ClN6Oc2820121019(111320)1630342523(2426(34)3222954821(22)3124)27(35)33(172925)1514186213718h468131617H1371415H2b3016+
MFCD04195817
ZINC000002434200
ZINC33369976
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