Vitas-M small molecule compound
methyl 2-amino-7,7-dimethyl-5-oxo-4-(pyridin-3-yl)-1-[2-(trifluoromethyl)phenyl]-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate
Catalog ID
STK756375
SMILES COC(=O)C1=C(N)N(C2=C(C1c1cccnc1)C(=O)CC(C2)(C)C)c1ccccc1C(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 C25H24F3N3O3 MW 471.48 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24F3N3O3/c1-24(2)11-17-20(18(32)12-24)19(14-7-6-10-30-13-14)21(23(33)34-3)22(29)31(17)16-9-5-4-8-15(16)25(26,27)28/h4-10,13,19H,11-12,29H2,1-3H3InChIKey
HBOXNKQAOLOOLZ-UHFFFAOYSA-NSynonyms
CC1(CC2=C(C(C(=C(N2C3=CC=CC=C3C(F)(F)F)N)C(=O)OC)C4=CN=CC=C4)C(=O)C1)C
InChI=1SC25H24F3N3O3c124(2)111720(18(32)1224)19(147610301314)21(23(33)343)22(29)31(17)16954815(16)25(2627)28h4101319H111229H213H3
methyl2amino77dimethyl5oxo4(pyridin3yl)1(2(trifluoromethyl)phenyl)145678hexahydroquinoline3carboxylate
METHYL2AMINO77DIMETHYL5OXO4PYRIDIN3YL1(2(TRIFLUOROMETHYL)PHENYL)68DIHYDRO4HQUINOLINE3CARBOXYLATE
MFCD01239775
ZINC000001058768
ZINC000001058771
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