1-(3-ethanoylphenyl)-3-[2-[[3-oxidanylidene-5-(phenylmethyl)piperazin-1-yl]methyl]cyclohexyl]urea

Systemtic Name: 1-(3-ethanoylphenyl)-3-[2-[[3-oxidanylidene-5-(phenylmethyl)piperazin-1-yl]methyl]cyclohexyl]urea Openeye Name: 1-(3-acetylphenyl)-3-[2-[(3-benzyl-5-oxo-piperazin-1-yl)methyl]cyclohexyl]urea CAS Name: 1-(3-acetylphenyl)-3-[2-[[3-oxo-5-(phenylmethyl)-1-piperazinyl]methyl]cyclohexyl]urea IUPAC Name: 1-(3-acetylphenyl)-3-[2-[(3-benzyl-5-oxopiperazin-1-yl)methyl]cyclohexyl]urea Traditional Name: 1-(3-acetylphenyl)-3-[2-[(3-benzyl-5-keto-piperazino)methyl]cyclohexyl]urea Formula: C27H34N4O3 MolecularWeight: 462.58386

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)NC2CCCCC2CN3CC(NC(=O)C3)CC4=CC=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)NC2CCCCC2CN3CC(NC(=O)C3)CC4=CC=CC=C4

InChI

InChI=1S/C27H34N4O3/c1-19(32)21-11-7-12-23(15-21)29-27(34)30-25-13-6-5-10-22(25)16-31-17-24(28-26(33)18-31)14-20-8-3-2-4-9-20/h2-4,7-9,11-12,15,22,24-25H,5-6,10,13-14,16-18H2,1H3,(H,28,33)(H2,29,30,34)