Vitas-M small molecule compound
3-(2-phenylethyl)-11-({(E)-[4-(propan-2-yl)phenyl]methylidene}amino)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL240441
SMILES CC(c1ccc(cc1)/C=N/n1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1)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 C30H26N6O MW 486.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H26N6O/c1-20(2)23-14-12-22(13-15-23)18-32-36-28-26(27-29(36)34-25-11-7-6-10-24(25)33-27)30(37)35(19-31-28)17-16-21-8-4-3-5-9-21/h3-15,18-20H,16-17H2,1-2H3/b32-18+InChIKey
QOHMMKOEXRTHSW-KCSSXMTESA-NSynonyms
861109-47-9(E)11((4isopropylbenzylidene)amino)3phenethyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
3(2phenylethyl)11(((E)(4(propan2yl)phenyl)methylidene)amino)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
861109479
CC(C)C1=CC=C(C=C1)C=NN2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C=N3)CCC6=CC=CC=C6
CC(c1ccc(cc1)C=Nn1c2ncn(c(=O)c2c2c1nc1ccccc1n2)CCc1ccccc1)C
InChI=1SC30H26N6Oc120(2)23141222(131523)1832362826(2729(36)342511761024(25)3327)30(37)35(193128)1716218435921h3151820H1617H212H3b3218+
MFCD04180707
ZINC000002234514
ZINC2234512
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