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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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