1-[2-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethyl]-3-(4-methylphenyl)urea

Systemtic Name: 1-[2-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethyl]-3-(4-methylphenyl)urea Openeye Name: 1-[2-(4-cyclohexylpiperazin-1-yl)-2-phenyl-ethyl]-3-(p-tolyl)urea CAS Name: 1-[2-(4-cyclohexyl-1-piperazinyl)-2-phenylethyl]-3-(4-methylphenyl)urea IUPAC Name: 1-[2-(4-cyclohexylpiperazin-1-yl)-2-phenylethyl]-3-(4-methylphenyl)urea Traditional Name: 1-[2-(4-cyclohexylpiperazino)-2-phenyl-ethyl]-3-(p-tolyl)urea Formula: C26H36N4O MolecularWeight: 420.59024

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NCC(C2=CC=CC=C2)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NCC(C2=CC=CC=C2)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C26H36N4O/c1-21-12-14-23(15-13-21)28-26(31)27-20-25(22-8-4-2-5-9-22)30-18-16-29(17-19-30)24-10-6-3-7-11-24/h2,4-5,8-9,12-15,24-25H,3,6-7,10-11,16-20H2,1H3,(H2,27,28,31)