1-(2,6-dimethylphenyl)-3-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]urea

Systemtic Name: 1-(2,6-dimethylphenyl)-3-[4-[4-(phenylcarbonyl)piperazin-1-yl]phenyl]urea Openeye Name: 1-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-(2,6-dimethylphenyl)urea CAS Name: 1-[4-(4-benzoyl-1-piperazinyl)phenyl]-3-(2,6-dimethylphenyl)urea IUPAC Name: 1-[4-(4-benzoylpiperazin-1-yl)phenyl]-3-(2,6-dimethylphenyl)urea Traditional Name: 1-[4-(4-benzoylpiperazino)phenyl]-3-(2,6-dimethylphenyl)urea Formula: C26H28N4O2 MolecularWeight: 428.52612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)NC2=CC=C(C=C2)N3CCN(CC3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C26H28N4O2/c1-19-7-6-8-20(2)24(19)28-26(32)27-22-11-13-23(14-12-22)29-15-17-30(18-16-29)25(31)21-9-4-3-5-10-21/h3-14H,15-18H2,1-2H3,(H2,27,28,32)