1-[4-(4-hexanoylpiperazin-1-yl)phenyl]-3-(phenylmethyl)urea

Systemtic Name: 1-[4-(4-hexanoylpiperazin-1-yl)phenyl]-3-(phenylmethyl)urea Openeye Name: 1-benzyl-3-[4-(4-hexanoylpiperazin-1-yl)phenyl]urea CAS Name: 1-[4-[4-(1-oxohexyl)-1-piperazinyl]phenyl]-3-(phenylmethyl)urea IUPAC Name: 1-benzyl-3-[4-(4-hexanoylpiperazin-1-yl)phenyl]urea Traditional Name: 1-benzyl-3-[4-(4-caproylpiperazino)phenyl]urea Formula: C24H32N4O2 MolecularWeight: 408.53648

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCCC(=O)N1CCN(CC1)C2=CC=C(C=C2)NC(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C24H32N4O2/c1-2-3-5-10-23(29)28-17-15-27(16-18-28)22-13-11-21(12-14-22)26-24(30)25-19-20-8-6-4-7-9-20/h4,6-9,11-14H,2-3,5,10,15-19H2,1H3,(H2,25,26,30)