Vitas-M small molecule compound
8,8-dimethyl-2-(propan-2-ylsulfanyl)-5-[2-(trifluoromethyl)phenyl]-5,8,9,10-tetrahydropyrimido[4,5-b]quinoline-4,6(3H,7H)-dione
Catalog ID
STK918718
SMILES CC(Sc1nc2NC3=C(C(c2c(=O)[nH]1)c1ccccc1C(F)(F)F)C(=O)CC(C3)(C)C)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 C23H24F3N3O2S MW 463.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24F3N3O2S/c1-11(2)32-21-28-19-18(20(31)29-21)16(12-7-5-6-8-13(12)23(24,25)26)17-14(27-19)9-22(3,4)10-15(17)30/h5-8,11,16H,9-10H2,1-4H3,(H2,27,28,29,31)InChIKey
OMYDFQDOPUBXIK-UHFFFAOYSA-NSynonyms
88dimethyl2(propan2ylsulfanyl)5(2(trifluoromethyl)phenyl)58910tetrahydropyrimido(45b)quinoline46(3H7H)dione
88dimethyl2propan2ylsulfanyl5(2(trifluoromethyl)phenyl)57910tetrahydro1Hpyrimido(45b)quinoline46dione
CC(C)SC1=NC(=O)C2=C(N1)NC3=C(C2C4=CC=CC=C4C(F)(F)F)C(=O)CC(C3)(C)C
CC(Sc1nc2NC3=C(C(c2c(=O)(nH)1)c1ccccc1C(F)(F)F)C(=O)CC(C3)(C)C)C
InChI=1SC23H24F3N3O2Sc111(2)3221281918(20(31)2921)16(12756813(12)23(2425)26)1714(2719)922(34)1015(17)30h581116H910H214H3(H227282931)
MFCD05990261
ZINC000016346462
ZINC000016346465
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