Vitas-M small molecule compound
11-(3,5-dimethylphenyl)-2-ethyl-3-(1-phenylethyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK549863
SMILES CCc1nc2n(c3cc(C)cc(c3)C)c3c(c2c(=O)n1C(c1ccccc1)C)nc1c(n3)cccc1
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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 C30H27N5O MW 473.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H27N5O/c1-5-25-33-28-26(30(36)34(25)20(4)21-11-7-6-8-12-21)27-29(32-24-14-10-9-13-23(24)31-27)35(28)22-16-18(2)15-19(3)17-22/h6-17,20H,5H2,1-4H3InChIKey
XSMLHLKIBAIOOF-UHFFFAOYSA-NSynonyms
799827-54-611(35dimethylphenyl)2ethyl3(1phenylethyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(35dimethylphenyl)2ethyl3(1phenylethyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
799827546
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=CC(=C5)C)C)C(=O)N1C(C)C6=CC=CC=C6
InChI=1SC30H27N5Oc1525332826(30(36)34(25)20(4)21117681221)2729(3224141091323(24)3127)35(28)221618(2)1519(3)1722h61720H5H214H3
MFCD03683577
ZINC000002240436
ZINC000002240437
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