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

Systemtic Name: 1-(3-fluoranyl-4-methyl-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: 1-(3-fluoro-4-methyl-phenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: 1-(3-fluoro-4-methylphenyl)-3-[3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(3-fluoro-4-methylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: 1-(3-fluoro-4-methyl-phenyl)-3-[3-(4-phenylpiperazino)propyl]urea Formula: C21H27FN4O MolecularWeight: 370.463683

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)NCCCN2CCN(CC2)C3=CC=CC=C3)F

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)NCCCN2CCN(CC2)C3=CC=CC=C3)F

InChI

InChI=1S/C21H27FN4O/c1-17-8-9-18(16-20(17)22)24-21(27)23-10-5-11-25-12-14-26(15-13-25)19-6-3-2-4-7-19/h2-4,6-9,16H,5,10-15H2,1H3,(H2,23,24,27)