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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H27N3S/c1-14-7-11-20(12-8-14)10-4-9-18-17(21)19-16-6-3-5-15(2)13-16/h3,5-6,13-14H,4,7-12H2,1-2H3,(H2,18,19,21)/p+1