3-cyclohexyl-1-phenethyl-1-[[2-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]urea

Systemtic Name: 3-cyclohexyl-1-phenethyl-1-[[2-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]urea Openeye Name: 3-cyclohexyl-1-phenethyl-1-[[2-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]urea CAS Name: 3-cyclohexyl-1-phenethyl-1-[[2-[3-(1-piperazinylmethyl)phenyl]phenyl]methyl]urea IUPAC Name: 3-cyclohexyl-1-phenethyl-1-[[2-[3-(piperazin-1-ylmethyl)phenyl]phenyl]methyl]urea Traditional Name: 3-cyclohexyl-1-phenethyl-1-[2-[3-(piperazinomethyl)phenyl]benzyl]urea Formula: C33H42N4O MolecularWeight: 510.71278

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3C4=CC(=CC=C4)CN5CCNCC5

Isomeric SMILES

C1CCC(CC1)NC(=O)N(CCC2=CC=CC=C2)CC3=CC=CC=C3C4=CC(=CC=C4)CN5CCNCC5

InChI

InChI=1S/C33H42N4O/c38-33(35-31-15-5-2-6-16-31)37(21-18-27-10-3-1-4-11-27)26-30-13-7-8-17-32(30)29-14-9-12-28(24-29)25-36-22-19-34-20-23-36/h1,3-4,7-14,17,24,31,34H,2,5-6,15-16,18-23,25-26H2,(H,35,38)