[1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium

Systemtic Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Openeye Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-methyl-(3-thienylmethyl)ammonium CAS Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)-4-pyrazolyl]methyl-methyl-(3-thiophenylmethyl)ammonium IUPAC Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-methyl-(thiophen-3-ylmethyl)azanium Traditional Name: [1-(2-fluorophenyl)-3-(4-methoxyphenyl)pyrazol-4-yl]methyl-methyl-(3-thenyl)ammonium Formula: C23H23FN3OS+ MolecularWeight: 408.511623

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC1=CSC=C1)CC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4F

Isomeric SMILES

C[NH+](CC1=CSC=C1)CC2=CN(N=C2C3=CC=C(C=C3)OC)C4=CC=CC=C4F

InChI

InChI=1S/C23H22FN3OS/c1-26(13-17-11-12-29-16-17)14-19-15-27(22-6-4-3-5-21(22)24)25-23(19)18-7-9-20(28-2)10-8-18/h3-12,15-16H,13-14H2,1-2H3/p+1