4-[(4-methoxyphenyl)methyl]-N-(2-methylphenyl)piperazin-4-ium-1-carbothioamide

Systemtic Name: 4-[(4-methoxyphenyl)methyl]-N-(2-methylphenyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-[(4-methoxyphenyl)methyl]-N-(o-tolyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-[(4-methoxyphenyl)methyl]-N-(2-methylphenyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-[(4-methoxyphenyl)methyl]-N-(2-methylphenyl)piperazin-4-ium-1-carbothioamide Traditional Name: N-(o-tolyl)-4-p-anisyl-piperazin-4-ium-1-carbothioamide Formula: C20H26N3OS+ MolecularWeight: 356.50494

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CC[NH+](CC2)CC3=CC=C(C=C3)OC

InChI

InChI=1S/C20H25N3OS/c1-16-5-3-4-6-19(16)21-20(25)23-13-11-22(12-14-23)15-17-7-9-18(24-2)10-8-17/h3-10H,11-15H2,1-2H3,(H,21,25)/p+1