1-(3,5-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(3,5-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: 1-(3,5-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: 1-(3,5-dimethylphenyl)-3-[3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(3,5-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: 1-(3,5-dimethylphenyl)-3-[3-(4-phenylpiperazino)propyl]urea Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H30N4O/c1-18-15-19(2)17-20(16-18)24-22(27)23-9-6-10-25-11-13-26(14-12-25)21-7-4-3-5-8-21/h3-5,7-8,15-17H,6,9-14H2,1-2H3,(H2,23,24,27)