3-(3,5-dimethylpyrazol-1-yl)propyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]azanium

Systemtic Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]azanium Openeye Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]ammonium CAS Name: 3-(3,5-dimethyl-1-pyrazolyl)propyl-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]ammonium IUPAC Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]azanium Traditional Name: 3-(3,5-dimethylpyrazol-1-yl)propyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]ammonium Formula: C22H26N5S+ MolecularWeight: 392.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCC[NH2+]CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1CCC[NH2+]CC2=CN(N=C2C3=CC=CS3)C4=CC=CC=C4)C

InChI

InChI=1S/C22H25N5S/c1-17-14-18(2)26(24-17)12-7-11-23-15-19-16-27(20-8-4-3-5-9-20)25-22(19)21-10-6-13-28-21/h3-6,8-10,13-14,16,23H,7,11-12,15H2,1-2H3/p+1