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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(CNC(=O)NC2=CC=C(C=C2)F)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1C(CNC(=O)NC2=CC=C(C=C2)F)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C26H35FN4O2/c1-33-25-10-6-5-9-23(25)24(19-28-26(32)29-21-13-11-20(27)12-14-21)31-17-15-30(16-18-31)22-7-3-2-4-8-22/h5-6,9-14,22,24H,2-4,7-8,15-19H2,1H3,(H2,28,29,32)