1-(2,3-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea

Systemtic Name: 1-(2,3-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Openeye Name: 1-(2,3-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea CAS Name: 1-(2,3-dimethylphenyl)-3-[3-(4-phenyl-1-piperazinyl)propyl]urea IUPAC Name: 1-(2,3-dimethylphenyl)-3-[3-(4-phenylpiperazin-1-yl)propyl]urea Traditional Name: 1-(2,3-dimethylphenyl)-3-[3-(4-phenylpiperazino)propyl]urea Formula: C22H30N4O MolecularWeight: 366.4998

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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