(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-[(2-fluoranyl-4-methyl-phenyl)amino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-(2-fluoro-4-methyl-anilino)-2-oxo-ethyl]-methyl-ammonium CAS Name: (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methylammonium IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-[2-(2-fluoro-4-methylanilino)-2-oxoethyl]-methylazanium Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-(2-fluoro-4-methyl-anilino)-2-keto-ethyl]-methyl-ammonium Formula: C22H26FN4O+ MolecularWeight: 381.466443

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=C(N(N=C2C)C3=CC=CC=C3)C)F

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)C[NH+](C)CC2=C(N(N=C2C)C3=CC=CC=C3)C)F

InChI

InChI=1S/C22H25FN4O/c1-15-10-11-21(20(23)12-15)24-22(28)14-26(4)13-19-16(2)25-27(17(19)3)18-8-6-5-7-9-18/h5-12H,13-14H2,1-4H3,(H,24,28)/p+1