Vitas-M small molecule compound
2-amino-1-[2-chloro-5-(trifluoromethyl)phenyl]-7,7-dimethyl-5-oxo-4-(thiophen-2-yl)-1,4,5,6,7,8-hexahydroquinoline-3-carbonitrile
Catalog ID
STK754906
SMILES N#CC1=C(N)N(C2=C(C1c1cccs1)C(=O)CC(C2)(C)C)c1cc(ccc1Cl)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 C23H19ClF3N3OS MW 477.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H19ClF3N3OS/c1-22(2)9-16-20(17(31)10-22)19(18-4-3-7-32-18)13(11-28)21(29)30(16)15-8-12(23(25,26)27)5-6-14(15)24/h3-8,19H,9-10,29H2,1-2H3InChIKey
BVEIKLNOSKTTFA-UHFFFAOYSA-NSynonyms
2amino1(2chloro5(trifluoromethyl)phenyl)77dimethyl5oxo4(thiophen2yl)145678hexahydroquinoline3carbonitrile
2AMINO1(2CHLORO5(TRIFLUOROMETHYL)PHENYL)77DIMETHYL5OXO4THIOPHEN2YL68DIHYDRO4HQUINOLINE3CARBONITRILE
CC1(CC2=C(C(C(=C(N2C3=C(C=CC(=C3)C(F)(F)F)Cl)N)C#N)C4=CC=CS4)C(=O)C1)C
InChI=1SC23H19ClF3N3OSc122(2)91620(17(31)1022)19(184373218)13(1128)21(29)30(16)15812(23(2526)27)5614(15)24h3819H91029H212H3
MFCD00826924
ZINC000000713608
ZINC000000713610
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