1-(4-methylphenyl)-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]thiourea

Systemtic Name: 1-(4-methylphenyl)-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]thiourea Openeye Name: 1-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-(p-tolyl)thiourea CAS Name: 1-(4-methylphenyl)-3-[[1-(1-piperidin-1-iumyl)cyclohexyl]methyl]thiourea IUPAC Name: 1-(4-methylphenyl)-3-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]thiourea Traditional Name: 1-[(1-piperidin-1-ium-1-ylcyclohexyl)methyl]-3-(p-tolyl)thiourea Formula: C20H32N3S+ MolecularWeight: 346.55318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=S)NCC2(CCCCC2)[NH+]3CCCCC3

Isomeric SMILES

CC1=CC=C(C=C1)NC(=S)NCC2(CCCCC2)[NH+]3CCCCC3

InChI

InChI=1S/C20H31N3S/c1-17-8-10-18(11-9-17)22-19(24)21-16-20(12-4-2-5-13-20)23-14-6-3-7-15-23/h8-11H,2-7,12-16H2,1H3,(H2,21,22,24)/p+1