1-[2-[[4-bromanyl-3-(trifluoromethyl)phenyl]amino]-1,3-thiazol-4-yl]butan-2-one

Systemtic Name: 1-[2-[[4-bromanyl-3-(trifluoromethyl)phenyl]amino]-1,3-thiazol-4-yl]butan-2-one Openeye Name: 1-[2-[4-bromo-3-(trifluoromethyl)anilino]thiazol-4-yl]butan-2-one CAS Name: 1-[2-[4-bromo-3-(trifluoromethyl)anilino]-4-thiazolyl]-2-butanone IUPAC Name: 1-[2-[4-bromo-3-(trifluoromethyl)anilino]-1,3-thiazol-4-yl]butan-2-one Traditional Name: 1-[2-[4-bromo-3-(trifluoromethyl)anilino]thiazol-4-yl]butan-2-one Formula: C14H12BrF3N2OS MolecularWeight: 393.22209

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1=CSC(=N1)NC2=CC(=C(C=C2)Br)C(F)(F)F

Isomeric SMILES

CCC(=O)CC1=CSC(=N1)NC2=CC(=C(C=C2)Br)C(F)(F)F

InChI

InChI=1S/C14H12BrF3N2OS/c1-2-10(21)5-9-7-22-13(20-9)19-8-3-4-12(15)11(6-8)14(16,17)18/h3-4,6-7H,2,5H2,1H3,(H,19,20)