(3,4-dimethylphenyl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium

Systemtic Name: (3,4-dimethylphenyl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium Openeye Name: (3,4-dimethylphenyl)methyl-(3-pyridylmethyl)-(2-thienylmethyl)ammonium CAS Name: (3,4-dimethylphenyl)methyl-(3-pyridinylmethyl)-(thiophen-2-ylmethyl)ammonium IUPAC Name: (3,4-dimethylphenyl)methyl-(pyridin-3-ylmethyl)-(thiophen-2-ylmethyl)azanium Traditional Name: (3,4-dimethylbenzyl)-(3-pyridylmethyl)-(2-thenyl)ammonium Formula: C20H23N2S+ MolecularWeight: 323.47502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C[NH+](CC2=CN=CC=C2)CC3=CC=CS3)C

Isomeric SMILES

CC1=C(C=C(C=C1)C[NH+](CC2=CN=CC=C2)CC3=CC=CS3)C

InChI

InChI=1S/C20H22N2S/c1-16-7-8-18(11-17(16)2)13-22(15-20-6-4-10-23-20)14-19-5-3-9-21-12-19/h3-12H,13-15H2,1-2H3/p+1