Vitas-M small molecule compound
3-(2-phenylethyl)-11-{[(E)-phenylmethylidene]amino}-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK555032
SMILES O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2/N=C/c1ccccc1
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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 C27H20N6O MW 444.50 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H20N6O/c34-27-23-24-26(31-22-14-8-7-13-21(22)30-24)33(29-17-20-11-5-2-6-12-20)25(23)28-18-32(27)16-15-19-9-3-1-4-10-19/h1-14,17-18H,15-16H2/b29-17+InChIKey
XRYYOXZVLBIRIY-STBIYBPSSA-NSynonyms
861820-65-7(E)11(benzylideneamino)3phenethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2phenylethyl)11(((E)phenylmethylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861820657
C1=CC=C(C=C1)CCN2C=NC3=C(C2=O)C4=NC5=CC=CC=C5N=C4N3N=CC6=CC=CC=C6
InChI=1SC27H20N6Oc3427232426(312214871321(22)3024)33(291720115261220)25(23)281832(27)16151993141019h1141718H1516H2b2917+
MFCD04008367
O=c1n(CCc2ccccc2)cnc2c1c1nc3ccccc3nc1n2N=Cc1ccccc1
ZINC000009463899
ZINC33929044
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