Vitas-M small molecule compound
3,4-dimethyl-6-{[3-(trifluoromethyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK378928
SMILES O=C(C1CC(=C(CC1C(=O)O)C)C)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 C17H18F3NO3 MW 341.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H18F3NO3/c1-9-6-13(14(16(23)24)7-10(9)2)15(22)21-12-5-3-4-11(8-12)17(18,19)20/h3-5,8,13-14H,6-7H2,1-2H3,(H,21,22)(H,23,24)InChIKey
LYWUAZCAWKLZHC-UHFFFAOYSA-NSynonyms
(1R6S)34DIMETHYL6((3(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
(1S6R)34DIMETHYL6((3(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
34DIMETHYL6((3(TRIFLUOROMETHYL)ANILINO)CARBONYL)3CYCLOHEXENE1CARBOXYLICACID
34dimethyl6((3(trifluoromethyl)phenyl)carbamoyl)cyclohex3ene1carboxylicacid
34DIMETHYL6(3TRIFLUOROMETHYLPHENYLCARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
3CYCLOHEXENE1CARBOXYLICACID34DIMETHYL6(((3(TRIFLUOROMETHYL)PHENYL)AMINO)CARBONYL)
CC1=C(CC(C(C1)C(=O)NC2=CC=CC(=C2)C(F)(F)F)C(=O)O)C
InChI=1SC17H18F3NO3c19613(14(16(23)24)710(9)2)15(22)211253411(812)17(1819)20h3581314H67H212H3(H2122)(H2324)
MFCD02018641
ZINC000002942790
ZINC000002942795
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