3-imidazol-1-ylpropyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]azanium

Systemtic Name: 3-imidazol-1-ylpropyl-[(1-phenyl-3-thiophen-2-yl-pyrazol-4-yl)methyl]azanium Openeye Name: 3-imidazol-1-ylpropyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]ammonium CAS Name: 3-(1-imidazolyl)propyl-[(1-phenyl-3-thiophen-2-yl-4-pyrazolyl)methyl]ammonium IUPAC Name: 3-imidazol-1-ylpropyl-[(1-phenyl-3-thiophen-2-ylpyrazol-4-yl)methyl]azanium Traditional Name: 3-imidazol-1-ylpropyl-[[1-phenyl-3-(2-thienyl)pyrazol-4-yl]methyl]ammonium Formula: C20H22N5S+ MolecularWeight: 364.48718

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C[NH2+]CCCN4C=CN=C4

Isomeric SMILES

C1=CC=C(C=C1)N2C=C(C(=N2)C3=CC=CS3)C[NH2+]CCCN4C=CN=C4

InChI

InChI=1S/C20H21N5S/c1-2-6-18(7-3-1)25-15-17(20(23-25)19-8-4-13-26-19)14-21-9-5-11-24-12-10-22-16-24/h1-4,6-8,10,12-13,15-16,21H,5,9,11,14H2/p+1