Vitas-M small molecule compound
11-[4-(butan-2-yl)phenyl]-2-ethyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990679
SMILES CCC(c1ccc(cc1)n1c2nc3ccccc3nc2c2c1nc(CC)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 C29H33N5O MW 467.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H33N5O/c1-6-19(5)20-12-14-21(15-13-20)34-27-25(26-28(34)31-23-11-9-8-10-22(23)30-26)29(35)33(17-16-18(3)4)24(7-2)32-27/h8-15,18-19H,6-7,16-17H2,1-5H3InChIKey
QHUAQVFCUUIJSE-UHFFFAOYSA-NSynonyms
11(4(butan2yl)phenyl)2ethyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
CCC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)C(C)CC)C(=O)N1CCC(C)C
InChI=1SC29H33N5Oc1619(5)20121421(151320)342725(2628(34)312311981022(23)3026)29(35)33(171618(3)4)24(72)3227h8151819H671617H215H3
MFCD05704365
ZINC000006150811
ZINC000006150814
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