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

Systemtic Name: 4-[(4-chlorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide Openeye Name: 4-[(4-chlorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide CAS Name: 4-[(4-chlorophenyl)methyl]-N-(4-methoxyphenyl)-1-piperazin-4-iumcarbothioamide IUPAC Name: 4-[(4-chlorophenyl)methyl]-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide Traditional Name: 4-(4-chlorobenzyl)-N-(4-methoxyphenyl)piperazin-4-ium-1-carbothioamide Formula: C19H23ClN3OS+ MolecularWeight: 376.92342

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=S)N2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

Isomeric SMILES

COC1=CC=C(C=C1)NC(=S)N2CC[NH+](CC2)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H22ClN3OS/c1-24-18-8-6-17(7-9-18)21-19(25)23-12-10-22(11-13-23)14-15-2-4-16(20)5-3-15/h2-9H,10-14H2,1H3,(H,21,25)/p+1