3-[(2-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3-diazinan-3-ium-1-carbothioamide

Systemtic Name: 3-[(2-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3-diazinan-3-ium-1-carbothioamide Openeye Name: 3-[(2-chlorophenyl)methyl]-N-(o-tolyl)hexahydropyrimidin-3-ium-1-carbothioamide CAS Name: 3-[(2-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3-diazinan-3-ium-1-carbothioamide IUPAC Name: 3-[(2-chlorophenyl)methyl]-N-(2-methylphenyl)-1,3-diazinan-3-ium-1-carbothioamide Traditional Name: 3-(2-chlorobenzyl)-N-(o-tolyl)hexahydropyrimidin-3-ium-1-carbothioamide Formula: C19H23ClN3S+ MolecularWeight: 360.92402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1NC(=S)N2CCC[NH+](C2)CC3=CC=CC=C3Cl

Isomeric SMILES

CC1=CC=CC=C1NC(=S)N2CCC[NH+](C2)CC3=CC=CC=C3Cl

InChI

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