Vitas-M small molecule compound
11-[4-(butan-2-yl)phenyl]-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990514
SMILES CCC(c1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(C)n(c2=O)CCC(C)C)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 C28H31N5O MW 453.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31N5O/c1-6-18(4)20-11-13-21(14-12-20)33-26-24(28(34)32(19(5)29-26)16-15-17(2)3)25-27(33)31-23-10-8-7-9-22(23)30-25/h7-14,17-18H,6,15-16H2,1-5H3InChIKey
HSGGXMMUCFOOLN-UHFFFAOYSA-NSynonyms
848728-35-811(4(butan2yl)phenyl)2methyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4(secbutyl)phenyl)3isopentyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
848728358
CCC(C)C1=CC=C(C=C1)N2C3=C(C4=NC5=CC=CC=C5N=C42)C(=O)N(C(=N3)C)CCC(C)C
InChI=1SC28H31N5Oc1618(4)20111321(141220)332624(28(34)32(19(5)2926)161517(2)3)2527(33)31231087922(23)3025h7141718H61516H215H3
MFCD04193651
ZINC000002428941
ZINC000002428942
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