1-(4-methylphenyl)-3-[3-(4-methylpiperidin-1-ium-1-yl)propyl]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[3-(4-methylpiperidin-1-ium-1-yl)propyl]thiourea Openeye Name: 1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-[3-(4-methyl-1-piperidin-1-iumyl)propyl]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[3-(4-methylpiperidin-1-ium-1-yl)propyl]thiourea Traditional Name: 1-[3-(4-methylpiperidin-1-ium-1-yl)propyl]-3-(p-tolyl)thiourea Formula: C17H28N3S+ MolecularWeight: 306.48932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCNC(=S)NC2=CC=C(C=C2)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCNC(=S)NC2=CC=C(C=C2)C

InChI

InChI=1S/C17H27N3S/c1-14-4-6-16(7-5-14)19-17(21)18-10-3-11-20-12-8-15(2)9-13-20/h4-7,15H,3,8-13H2,1-2H3,(H2,18,19,21)/p+1