[1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate

Systemtic Name: [1-[(4-bromanyl-2-fluoranyl-phenyl)amino]-1-oxidanylidene-butan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Openeye Name: 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]propyl 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate CAS Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid [1-(4-bromo-2-fluoroanilino)-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-bromo-2-fluoroanilino)-1-oxobutan-2-yl] 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoate Traditional Name: 4-(4,5-dimethyl-1H-imidazol-2-yl)benzoic acid 1-[(4-bromo-2-fluoro-phenyl)carbamoyl]propyl ester Formula: C22H21BrFN3O3 MolecularWeight: 474.322843

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC=C(C=C2)C3=NC(=C(N3)C)C

Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)Br)F)OC(=O)C2=CC=C(C=C2)C3=NC(=C(N3)C)C

InChI

InChI=1S/C22H21BrFN3O3/c1-4-19(21(28)27-18-10-9-16(23)11-17(18)24)30-22(29)15-7-5-14(6-8-15)20-25-12(2)13(3)26-20/h5-11,19H,4H2,1-3H3,(H,25,26)(H,27,28)