1-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-3-(4-propan-2-ylphenyl)urea

Systemtic Name: 1-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-(4-isopropylphenyl)-3-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]urea CAS Name: 1-[[1-(4-methyl-1-piperazin-4-iumyl)cyclohexyl]methyl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-[[1-(4-methylpiperazin-4-ium-1-yl)cyclohexyl]methyl]-3-p-cumenyl-urea Formula: C22H37N4O+ MolecularWeight: 373.55538

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)NCC2(CCCCC2)N3CC[NH+](CC3)C

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)NCC2(CCCCC2)N3CC[NH+](CC3)C

InChI

InChI=1S/C22H36N4O/c1-18(2)19-7-9-20(10-8-19)24-21(27)23-17-22(11-5-4-6-12-22)26-15-13-25(3)14-16-26/h7-10,18H,4-6,11-17H2,1-3H3,(H2,23,24,27)/p+1