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

Systemtic Name: 1-(4-tert-butylphenyl)-3-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]urea Openeye Name: 1-(4-tert-butylphenyl)-3-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]urea CAS Name: 1-(4-tert-butylphenyl)-3-[4-[(4-phenyl-1-piperazinyl)methyl]phenyl]urea IUPAC Name: 1-(4-tert-butylphenyl)-3-[4-[(4-phenylpiperazin-1-yl)methyl]phenyl]urea Traditional Name: 1-(4-tert-butylphenyl)-3-[4-[(4-phenylpiperazino)methyl]phenyl]urea Formula: C28H34N4O MolecularWeight: 442.59576

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H34N4O/c1-28(2,3)23-11-15-25(16-12-23)30-27(33)29-24-13-9-22(10-14-24)21-31-17-19-32(20-18-31)26-7-5-4-6-8-26/h4-16H,17-21H2,1-3H3,(H2,29,30,33)