1-[[4-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea

Systemtic Name: 1-[[4-[4-(5-chloranyl-2-fluoranyl-phenyl)carbonylpiperazin-1-yl]carbonylphenyl]methyl]-3-propan-2-yl-urea Openeye Name: 1-[[4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]phenyl]methyl]-3-isopropyl-urea CAS Name: 1-[[4-[[4-[(5-chloro-2-fluorophenyl)-oxomethyl]-1-piperazinyl]-oxomethyl]phenyl]methyl]-3-propan-2-ylurea IUPAC Name: 1-[[4-[4-(5-chloro-2-fluorobenzoyl)piperazine-1-carbonyl]phenyl]methyl]-3-propan-2-ylurea Traditional Name: 1-[4-[4-(5-chloro-2-fluoro-benzoyl)piperazine-1-carbonyl]benzyl]-3-isopropyl-urea Formula: C23H26ClFN4O3 MolecularWeight: 460.928943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

Isomeric SMILES

CC(C)NC(=O)NCC1=CC=C(C=C1)C(=O)N2CCN(CC2)C(=O)C3=C(C=CC(=C3)Cl)F

InChI

InChI=1S/C23H26ClFN4O3/c1-15(2)27-23(32)26-14-16-3-5-17(6-4-16)21(30)28-9-11-29(12-10-28)22(31)19-13-18(24)7-8-20(19)25/h3-8,13,15H,9-12,14H2,1-2H3,(H2,26,27,32)