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

Systemtic Name: 1-(4-methylphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea Openeye Name: 1-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(p-tolyl)urea CAS Name: 1-(4-methylphenyl)-3-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]urea IUPAC Name: 1-(4-methylphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea Traditional Name: 1-[4-(4-caprylylpiperazino)phenyl]-3-(p-tolyl)urea Formula: C26H36N4O2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C

Isomeric SMILES

CCCCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NC3=CC=C(C=C3)C

InChI

InChI=1S/C26H36N4O2/c1-3-4-5-6-7-8-25(31)30-19-17-29(18-20-30)24-15-13-23(14-16-24)28-26(32)27-22-11-9-21(2)10-12-22/h9-16H,3-8,17-20H2,1-2H3,(H2,27,28,32)