Vitas-M small molecule compound
3-(butan-2-yl)-11-(3-chloro-4-methoxyphenyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STL344605
SMILES COc1ccc(cc1Cl)n1c2nc3ccccc3nc2c2c1ncn(c2=O)C(CC)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 C23H20ClN5O2 MW 433.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H20ClN5O2/c1-4-13(2)28-12-25-21-19(23(28)30)20-22(27-17-8-6-5-7-16(17)26-20)29(21)14-9-10-18(31-3)15(24)11-14/h5-13H,4H2,1-3H3InChIKey
BOUXTUYOOMQXSJ-UHFFFAOYSA-NSynonyms
847038-33-93(butan2yl)11(3chloro4methoxyphenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)11(3chloro4methoxyphenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
847038339
CCC(C)N1C=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)OC)Cl
InChI=1SC23H20ClN5O2c1413(2)2812252119(23(28)30)2022(2717865716(17)2620)29(21)1491018(313)15(24)1114h513H4H213H3
MFCD04178571
ZINC000009158225
ZINC000009158226
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