Vitas-M small molecule compound
3-(4-bromobenzyl)-4-oxo-4-{[3-(trifluoromethyl)phenyl]amino}butanoic acid
Catalog ID
STK034007
SMILES OC(=O)CC(C(=O)Nc1cccc(c1)C(F)(F)F)Cc1ccc(cc1)Br
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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 C18H15BrF3NO3 MW 430.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H15BrF3NO3/c19-14-6-4-11(5-7-14)8-12(9-16(24)25)17(26)23-15-3-1-2-13(10-15)18(20,21)22/h1-7,10,12H,8-9H2,(H,23,26)(H,24,25)InChIKey
VKZIDSDAWRSUGE-UHFFFAOYSA-NSynonyms
3((4BROMOPHENYL)METHYL)4OXO4(3(TRIFLUOROMETHYL)ANILINO)BUTANOICACID
3(4BROMOBENZYL)4OXO4((3(TRIFLUOROMETHYL)PHENYL)AMINO)BUTANOICACID
4(4BROMOPHENYL)3(N(3(TRIFLUOROMETHYL)PHENYL)CARBAMOYL)BUTANOICACID
C1=CC(=CC(=C1)NC(=O)C(CC2=CC=C(C=C2)Br)CC(=O)O)C(F)(F)F
InChI=1SC18H15BrF3NO3c19146411(5714)812(916(24)25)17(26)231531213(1015)18(2021)22h171012H89H2(H2326)(H2425)
MFCD02766857
OC(=O)CC(C(=O)Nc1cccc(c1)C(F)(F)F)Cc1ccc(cc1)Br
STK034007
ZINC000009144708
ZINC000012428813
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