N-[(4-methylphenyl)methyl]-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide

Systemtic Name: N-[(4-methylphenyl)methyl]-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide Openeye Name: N-(p-tolylmethyl)-4-(2-thienylmethyl)piperazin-4-ium-1-carboxamide CAS Name: N-[(4-methylphenyl)methyl]-4-(thiophen-2-ylmethyl)-1-piperazin-4-iumcarboxamide IUPAC Name: N-[(4-methylphenyl)methyl]-4-(thiophen-2-ylmethyl)piperazin-4-ium-1-carboxamide Traditional Name: N-(4-methylbenzyl)-4-(2-thenyl)piperazin-4-ium-1-carboxamide Formula: C18H24N3OS+ MolecularWeight: 330.46766

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3OS/c1-15-4-6-16(7-5-15)13-19-18(22)21-10-8-20(9-11-21)14-17-3-2-12-23-17/h2-7,12H,8-11,13-14H2,1H3,(H,19,22)/p+1