1-cyclohexyl-3-[3-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-3-oxidanylidene-propyl]urea

Systemtic Name: 1-cyclohexyl-3-[3-[4-(4-ethanoyl-2-fluoranyl-phenyl)piperazin-1-yl]-3-oxidanylidene-propyl]urea Openeye Name: 1-[3-[4-(4-acetyl-2-fluoro-phenyl)piperazin-1-yl]-3-oxo-propyl]-3-cyclohexyl-urea CAS Name: 1-[3-[4-(4-acetyl-2-fluorophenyl)-1-piperazinyl]-3-oxopropyl]-3-cyclohexylurea IUPAC Name: 1-[3-[4-(4-acetyl-2-fluorophenyl)piperazin-1-yl]-3-oxopropyl]-3-cyclohexylurea Traditional Name: 1-[3-[4-(4-acetyl-2-fluoro-phenyl)piperazino]-3-keto-propyl]-3-cyclohexyl-urea Formula: C22H31FN4O3 MolecularWeight: 418.504943

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CCNC(=O)NC3CCCCC3)F

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)N2CCN(CC2)C(=O)CCNC(=O)NC3CCCCC3)F

InChI

InChI=1S/C22H31FN4O3/c1-16(28)17-7-8-20(19(23)15-17)26-11-13-27(14-12-26)21(29)9-10-24-22(30)25-18-5-3-2-4-6-18/h7-8,15,18H,2-6,9-14H2,1H3,(H2,24,25,30)