3-(3-bromanyl-4-fluoranyl-phenyl)-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]prop-2-enamide

Systemtic Name: 3-(3-bromanyl-4-fluoranyl-phenyl)-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]prop-2-enamide Openeye Name: 3-(3-bromo-4-fluoro-phenyl)-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]prop-2-enamide CAS Name: 3-(3-bromo-4-fluorophenyl)-N-[1-(3-methoxy-3-methylbutyl)-4-pyrazolyl]-2-propenamide IUPAC Name: 3-(3-bromo-4-fluorophenyl)-N-[1-(3-methoxy-3-methylbutyl)pyrazol-4-yl]prop-2-enamide Traditional Name: 3-(3-bromo-4-fluoro-phenyl)-N-[1-(3-methoxy-3-methyl-butyl)pyrazol-4-yl]acrylamide Formula: C18H21BrFN3O2 MolecularWeight: 410.280643

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCN1C=C(C=N1)NC(=O)C=CC2=CC(=C(C=C2)F)Br)OC

Isomeric SMILES

CC(C)(CCN1C=C(C=N1)NC(=O)C=CC2=CC(=C(C=C2)F)Br)OC

InChI

InChI=1S/C18H21BrFN3O2/c1-18(2,25-3)8-9-23-12-14(11-21-23)22-17(24)7-5-13-4-6-16(20)15(19)10-13/h4-7,10-12H,8-9H2,1-3H3,(H,22,24)