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

Systemtic Name: 1-(2,5-dimethylphenyl)-4-[(5-methylthiophen-2-yl)methyl]piperazin-4-ium Openeye Name: 1-(2,5-dimethylphenyl)-4-[(5-methyl-2-thienyl)methyl]piperazin-4-ium CAS Name: 1-(2,5-dimethylphenyl)-4-[(5-methyl-2-thiophenyl)methyl]piperazin-4-ium IUPAC Name: 1-(2,5-dimethylphenyl)-4-[(5-methylthiophen-2-yl)methyl]piperazin-4-ium Traditional Name: 1-(2,5-dimethylphenyl)-4-[(5-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=CC=C(S3)C

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CC[NH+](CC2)CC3=CC=C(S3)C

InChI

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