Vitas-M small molecule compound
6-{[2-chloro-5-(trifluoromethyl)phenyl]carbamoyl}cyclohex-3-ene-1-carboxylic acid
Catalog ID
STK057635
SMILES O=C(C1CC=CCC1C(=O)O)Nc1cc(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 C15H13ClF3NO3 MW 347.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H13ClF3NO3/c16-11-6-5-8(15(17,18)19)7-12(11)20-13(21)9-3-1-2-4-10(9)14(22)23/h1-2,5-7,9-10H,3-4H2,(H,20,21)(H,22,23)InChIKey
XMJBBSPXYYWVOW-UHFFFAOYSA-NSynonyms
330836-52-7330836527
6((2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)CYCLOHEX3ENE1CARBOXYLICACID
6(N(2CHLORO5(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)CYCLOHEX3ENECARBOXYLICACID
C1C=CCC(C1C(=O)NC2=C(C=CC(=C2)C(F)(F)F)Cl)C(=O)O
InChI=1SC15H13ClF3NO3c1611658(15(1718)19)712(11)2013(21)9312410(9)14(22)23h1257910H34H2(H2021)(H2223)
MFCD00760440
O=C(C1CC=CCC1C(=O)O)Nc1cc(ccc1Cl)C(F)(F)F
STK057635
ZINC000001177093
ZINC000004523508
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