3-butyl-1-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1-(3-propylphenyl)urea

Systemtic Name: 3-butyl-1-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1-(3-propylphenyl)urea Openeye Name: 3-butyl-1-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1-(3-propylphenyl)urea CAS Name: 3-butyl-1-[3-[4-(4-chlorophenyl)-1-piperazinyl]propoxy]-1-(3-propylphenyl)urea IUPAC Name: 3-butyl-1-[3-[4-(4-chlorophenyl)piperazin-1-yl]propoxy]-1-(3-propylphenyl)urea Traditional Name: 3-butyl-1-[3-[4-(4-chlorophenyl)piperazino]propoxy]-1-(3-propylphenyl)urea Formula: C27H39ClN4O2 MolecularWeight: 487.07716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)N(C1=CC=CC(=C1)CCC)OCCCN2CCN(CC2)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCCCNC(=O)N(C1=CC=CC(=C1)CCC)OCCCN2CCN(CC2)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C27H39ClN4O2/c1-3-5-15-29-27(33)32(26-10-6-9-23(22-26)8-4-2)34-21-7-16-30-17-19-31(20-18-30)25-13-11-24(28)12-14-25/h6,9-14,22H,3-5,7-8,15-21H2,1-2H3,(H,29,33)