1-(2,5-dimethylphenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(2,5-dimethylphenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(2,5-dimethylphenyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-4-ium CAS Name: 1-(2,5-dimethylphenyl)-4-[(3-methyl-2-thiophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2,5-dimethylphenyl)-4-[(3-methylthiophen-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(2,5-dimethylphenyl)-4-[(3-methyl-2-thienyl)methyl]piperazin-4-ium Formula: C18H25N2S+ MolecularWeight: 301.4695

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=C(C=CS3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=C(C=CS3)C

InChI

InChI=1S/C18H24N2S/c1-14-4-5-15(2)17(12-14)20-9-7-19(8-10-20)13-18-16(3)6-11-21-18/h4-6,11-12H,7-10,13H2,1-3H3/p+1