N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-methylsulfanylphenyl)methanimine

Systemtic Name: N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-methylsulfanylphenyl)methanimine Openeye Name: N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-methylsulfanylphenyl)methanimine CAS Name: N-[4-[(2-chlorophenyl)methyl]-1-piperazin-4-iumyl]-1-[4-(methylthio)phenyl]methanimine IUPAC Name: N-[4-[(2-chlorophenyl)methyl]piperazin-4-ium-1-yl]-1-(4-methylsulfanylphenyl)methanimine Traditional Name: (E)-[4-(2-chlorobenzyl)piperazin-4-ium-1-yl]-[4-(methylthio)benzylidene]amine Formula: C19H23ClN3S+ MolecularWeight: 360.92402

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C=NN2CC[NH+](CC2)CC3=CC=CC=C3Cl

Isomeric SMILES

CSC1=CC=C(C=C1)/C=N/N2CC[NH+](CC2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C19H22ClN3S/c1-24-18-8-6-16(7-9-18)14-21-23-12-10-22(11-13-23)15-17-4-2-3-5-19(17)20/h2-9,14H,10-13,15H2,1H3/p+1/b21-14+