Vitas-M small molecule compound
3-heptyl-2-methyl-11-[3-(trifluoromethyl)phenyl]-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK714289
SMILES CCCCCCCn1c(C)nc2c(c1=O)c1nc3ccccc3nc1n2c1cccc(c1)C(F)(F)F
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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 C27H26F3N5O MW 493.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H26F3N5O/c1-3-4-5-6-9-15-34-17(2)31-24-22(26(34)36)23-25(33-21-14-8-7-13-20(21)32-23)35(24)19-12-10-11-18(16-19)27(28,29)30/h7-8,10-14,16H,3-6,9,15H2,1-2H3InChIKey
OKXVACIMQAOCHC-UHFFFAOYSA-NSynonyms
844659-26-33heptyl2methyl11(3(trifluoromethyl)phenyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
3heptyl2methyl11(3(trifluoromethyl)phenyl)3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
844659263
CCCCCCCN1C(=NC2=C(C1=O)C3=NC4=CC=CC=C4N=C3N2C5=CC=CC(=C5)C(F)(F)F)C
InChI=1SC27H26F3N5Oc134569153417(2)312422(26(34)36)2325(332114871320(21)3223)35(24)1912101118(1619)27(2829)30h78101416H36915H212H3
MFCD04159664
ZINC000097954153
ZINC97954153
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