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

Systemtic Name: 1-(4-methylphenyl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-3-(p-tolyl)urea CAS Name: 1-(4-methylphenyl)-3-[4-[(4-methyl-1-piperazinyl)methyl]phenyl]urea IUPAC Name: 1-(4-methylphenyl)-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-[4-[(4-methylpiperazino)methyl]phenyl]-3-(p-tolyl)urea Formula: C20H26N4O MolecularWeight: 338.44664

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N4O/c1-16-3-7-18(8-4-16)21-20(25)22-19-9-5-17(6-10-19)15-24-13-11-23(2)12-14-24/h3-10H,11-15H2,1-2H3,(H2,21,22,25)