1-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(4-propan-2-ylphenyl)urea

Systemtic Name: 1-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(4-propan-2-ylphenyl)urea Openeye Name: 1-(4-isopropylphenyl)-3-[4-(4-octanoylpiperazin-1-yl)phenyl]urea CAS Name: 1-[4-[4-(1-oxooctyl)-1-piperazinyl]phenyl]-3-(4-propan-2-ylphenyl)urea IUPAC Name: 1-[4-(4-octanoylpiperazin-1-yl)phenyl]-3-(4-propan-2-ylphenyl)urea Traditional Name: 1-[4-(4-caprylylpiperazino)phenyl]-3-p-cumenyl-urea Formula: C28H40N4O2 MolecularWeight: 464.6428

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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(C)C

Isomeric SMILES

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

InChI

InChI=1S/C28H40N4O2/c1-4-5-6-7-8-9-27(33)32-20-18-31(19-21-32)26-16-14-25(15-17-26)30-28(34)29-24-12-10-23(11-13-24)22(2)3/h10-17,22H,4-9,18-21H2,1-3H3,(H2,29,30,34)