1-[2-(4-cyclohexylpiperazin-1-yl)-2-(4-methoxyphenyl)ethyl]-3-(4-fluorophenyl)urea

Systemtic Name: 1-[2-(4-cyclohexylpiperazin-1-yl)-2-(4-methoxyphenyl)ethyl]-3-(4-fluorophenyl)urea Openeye Name: 1-[2-(4-cyclohexylpiperazin-1-yl)-2-(4-methoxyphenyl)ethyl]-3-(4-fluorophenyl)urea CAS Name: 1-[2-(4-cyclohexyl-1-piperazinyl)-2-(4-methoxyphenyl)ethyl]-3-(4-fluorophenyl)urea IUPAC Name: 1-[2-(4-cyclohexylpiperazin-1-yl)-2-(4-methoxyphenyl)ethyl]-3-(4-fluorophenyl)urea Traditional Name: 1-[2-(4-cyclohexylpiperazino)-2-(4-methoxyphenyl)ethyl]-3-(4-fluorophenyl)urea Formula: C26H35FN4O2 MolecularWeight: 454.580103

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)NC2=CC=C(C=C2)F)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

COC1=CC=C(C=C1)C(CNC(=O)NC2=CC=C(C=C2)F)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C26H35FN4O2/c1-33-24-13-7-20(8-14-24)25(19-28-26(32)29-22-11-9-21(27)10-12-22)31-17-15-30(16-18-31)23-5-3-2-4-6-23/h7-14,23,25H,2-6,15-19H2,1H3,(H2,28,29,32)