[5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(2-thienylmethyl)ammonium CAS Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: [5-(3,4-dimethylphenyl)-1H-pyrazol-4-yl]methyl-(2-hydroxyethyl)-(2-thenyl)ammonium Formula: C19H24N3OS+ MolecularWeight: 342.47836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH+](CCO)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C2=C(C=NN2)C[NH+](CCO)CC3=CC=CS3)C

InChI

InChI=1S/C19H23N3OS/c1-14-5-6-16(10-15(14)2)19-17(11-20-21-19)12-22(7-8-23)13-18-4-3-9-24-18/h3-6,9-11,23H,7-8,12-13H2,1-2H3,(H,20,21)/p+1