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

Systemtic Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-[(2-fluorophenyl)carbamoylamino]-2-oxidanylidene-ethyl]-methyl-azanium Openeye Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-[(2-fluorophenyl)carbamoylamino]-2-oxo-ethyl]-methyl-ammonium CAS Name: (3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl-[2-[[(2-fluoroanilino)-oxomethyl]amino]-2-oxoethyl]-methylammonium IUPAC Name: (3,5-dimethyl-1-phenylpyrazol-4-yl)methyl-[2-[(2-fluorophenyl)carbamoylamino]-2-oxoethyl]-methylazanium Traditional Name: (3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl-[2-[(2-fluorophenyl)carbamoylamino]-2-keto-ethyl]-methyl-ammonium Formula: C22H25FN5O2+ MolecularWeight: 410.464603

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C[NH+](C)CC(=O)NC(=O)NC3=CC=CC=C3F

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)C[NH+](C)CC(=O)NC(=O)NC3=CC=CC=C3F

InChI

InChI=1S/C22H24FN5O2/c1-15-18(16(2)28(26-15)17-9-5-4-6-10-17)13-27(3)14-21(29)25-22(30)24-20-12-8-7-11-19(20)23/h4-12H,13-14H2,1-3H3,(H2,24,25,29,30)/p+1