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

Systemtic Name: 1-(4-methylphenyl)-3-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]-3-(p-tolyl)urea CAS Name: 1-(4-methylphenyl)-3-[4-[(4-phenyl-1-piperazinyl)methyl]phenyl]urea IUPAC Name: 1-(4-methylphenyl)-3-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-[4-[(4-phenylpiperazino)methyl]phenyl]-3-(p-tolyl)urea Formula: C25H28N4O MolecularWeight: 400.51602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)NC2=CC=C(C=C2)CN3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C25H28N4O/c1-20-7-11-22(12-8-20)26-25(30)27-23-13-9-21(10-14-23)19-28-15-17-29(18-16-28)24-5-3-2-4-6-24/h2-14H,15-19H2,1H3,(H2,26,27,30)