Vitas-M small molecule compound
3-butyl-11-(4-ethoxyphenyl)-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714234
SMILES CCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(cc1)OCC
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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 C25H25N5O2 MW 427.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H25N5O2/c1-4-6-15-29-16(3)26-23-21(25(29)31)22-24(28-20-10-8-7-9-19(20)27-22)30(23)17-11-13-18(14-12-17)32-5-2/h7-14H,4-6,15H2,1-3H3InChIKey
CTHQSXHPISFXGJ-UHFFFAOYSA-NSynonyms
3butyl11(4ethoxyphenyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3butyl11(4ethoxyphenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
CCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=C(C=C5)OCC)C
InChI=1SC25H25N5O2c146152916(3)262321(25(29)31)2224(28201087919(20)2722)30(23)17111318(141217)3252h714H4615H213H3
MFCD02991144
ZINC000006150728
ZINC06150728
ZINC6150728
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