Vitas-M small molecule compound
8-ethyl-5-oxo-2-(4-{[3-(trifluoromethyl)phenyl]carbamothioyl}piperazin-1-yl)-5,8-dihydropyrido[2,3-d]pyrimidine-6-carboxylic acid
Catalog ID
STK333894
SMILES CCn1cc(C(=O)O)c(=O)c2c1nc(nc2)N1CCN(CC1)C(=S)Nc1cccc(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 C22H21F3N6O3S MW 506.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21F3N6O3S/c1-2-29-12-16(19(33)34)17(32)15-11-26-20(28-18(15)29)30-6-8-31(9-7-30)21(35)27-14-5-3-4-13(10-14)22(23,24)25/h3-5,10-12H,2,6-9H2,1H3,(H,27,35)(H,33,34)InChIKey
USYVBPXJSBDUTJ-UHFFFAOYSA-NSynonyms
634175-34-12(4(((3TRIFLUOROMETHYLPHENYL)AMINO)CARBONOTHIOYL)1PIPERAZINYL)8ETHYL5OXO58DIHYDROPYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
634175341
8ethyl5oxo2(4((3(trifluoromethyl)phenyl)carbamothioyl)piperazin1yl)58dihydropyrido(23d)pyrimidine6carboxylicacid
8ETHYL5OXO2(4((3(TRIFLUOROMETHYL)PHENYL)CARBAMOTHIOYL)PIPERAZIN1YL)PYRIDO(23D)PYRIMIDINE6CARBOXYLICACID
CCN1C=C(C(=O)C2=CN=C(N=C21)N3CCN(CC3)C(=S)NC4=CC=CC(=C4)C(F)(F)F)C(=O)O
InChI=1SC22H21F3N6O3Sc12291216(19(33)34)17(32)15112620(2818(15)29)306831(9730)21(35)271453413(1014)22(2324)25h351012H269H21H3(H2735)(H3334)
MFCD03820271
ZINC000001440909
ZINC1440909
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