(4,5-dimethylthiophen-3-yl)-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone

Systemtic Name: (4,5-dimethylthiophen-3-yl)-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Openeye Name: (4,5-dimethyl-3-thienyl)-[4-(p-tolylmethyl)piperazin-4-ium-1-yl]methanone CAS Name: (4,5-dimethyl-3-thiophenyl)-[4-[(4-methylphenyl)methyl]-1-piperazin-4-iumyl]methanone IUPAC Name: (4,5-dimethylthiophen-3-yl)-[4-[(4-methylphenyl)methyl]piperazin-4-ium-1-yl]methanone Traditional Name: (4,5-dimethyl-3-thienyl)-[4-(4-methylbenzyl)piperazin-4-ium-1-yl]methanone Formula: C19H25N2OS+ MolecularWeight: 329.4796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CSC(=C3C)C

Isomeric SMILES

CC1=CC=C(C=C1)C[NH+]2CCN(CC2)C(=O)C3=CSC(=C3C)C

InChI

InChI=1S/C19H24N2OS/c1-14-4-6-17(7-5-14)12-20-8-10-21(11-9-20)19(22)18-13-23-16(3)15(18)2/h4-7,13H,8-12H2,1-3H3/p+1