Vitas-M small molecule compound
3-(butan-2-yl)-11-[4-chloro-3-(trifluoromethyl)phenyl]-2-methyl-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990586
SMILES CCC(n1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1ccc(c(c1)C(F)(F)F)Cl)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 C24H19ClF3N5O MW 485.90 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H19ClF3N5O/c1-4-12(2)32-13(3)29-21-19(23(32)34)20-22(31-18-8-6-5-7-17(18)30-20)33(21)14-9-10-16(25)15(11-14)24(26,27)28/h5-12H,4H2,1-3H3InChIKey
DUYATWHMWZUGQI-UHFFFAOYSA-NSynonyms
848279-22-13(butan2yl)11(4chloro3(trifluoromethyl)phenyl)2methyl311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3(secbutyl)11(4chloro3(trifluoromethyl)phenyl)2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
848279221
CCC(C)N1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)Cl)C(F)(F)F)C
InChI=1SC24H19ClF3N5Oc1412(2)3213(3)292119(23(32)34)2022(3118865717(18)3020)33(21)1491016(25)15(1114)24(2627)28h512H4H213H3
MFCD04186511
ZINC000002420088
ZINC000002420089
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