Vitas-M small molecule compound
11-[4-chloro-3-(trifluoromethyl)phenyl]-2-methyl-3-(3-methylbutyl)-3,11-dihydro-4H-pyrimido[5',4':4,5]pyrrolo[2,3-b]quinoxalin-4-one
Catalog ID
STK990515
SMILES CC(CCn1c(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 C25H21ClF3N5O MW 499.92 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H21ClF3N5O/c1-13(2)10-11-33-14(3)30-22-20(24(33)35)21-23(32-19-7-5-4-6-18(19)31-21)34(22)15-8-9-17(26)16(12-15)25(27,28)29/h4-9,12-13H,10-11H2,1-3H3InChIKey
TYLDDPSCBKVOHI-UHFFFAOYSA-NSynonyms
847045-60-711(4chloro3(trifluoromethyl)phenyl)2methyl3(3methylbutyl)311dihydro4Hpyrimido(5445)pyrrolo(23b)quinoxalin4one
11(4chloro3(trifluoromethyl)phenyl)3isopentyl2methyl3Hpyrimido(5445)pyrrolo(23b)quinoxalin4(11H)one
847045607
CC1=NC2=C(C3=NC4=CC=CC=C4N=C3N2C5=CC(=C(C=C5)Cl)C(F)(F)F)C(=O)N1CCC(C)C
InChI=1SC25H21ClF3N5Oc113(2)10113314(3)302220(24(33)35)2123(3219754618(19)3121)34(22)158917(26)16(1215)25(2728)29h491213H1011H213H3
MFCD04182058
ZINC000002333708
ZINC02333708
ZINC2333708
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