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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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