1-(4-bromanyl-2-fluoranyl-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(4-bromanyl-2-fluoranyl-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: 1-(4-bromo-2-fluoro-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: 1-(4-bromo-2-fluorophenyl)-3-[3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(4-bromo-2-fluorophenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: 1-(4-bromo-2-fluoro-phenyl)-3-[3-(4-phenylpiperazino)propyl]urea Formula: C20H24BrFN4O MolecularWeight: 435.333163

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCNC(=O)NC2=C(C=C(C=C2)Br)F)C3=CC=CC=C3

Isomeric SMILES

C1CN(CCN1CCCNC(=O)NC2=C(C=C(C=C2)Br)F)C3=CC=CC=C3

InChI

InChI=1S/C20H24BrFN4O/c21-16-7-8-19(18(22)15-16)24-20(27)23-9-4-10-25-11-13-26(14-12-25)17-5-2-1-3-6-17/h1-3,5-8,15H,4,9-14H2,(H2,23,24,27)