1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-(3-ethanoylphenyl)-1-(furan-2-ylmethyl)urea

Systemtic Name: 1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-3-(3-ethanoylphenyl)-1-(furan-2-ylmethyl)urea Openeye Name: 3-(3-acetylphenyl)-1-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-1-(2-furylmethyl)urea CAS Name: 3-(3-acetylphenyl)-1-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-1-(2-furanylmethyl)urea IUPAC Name: 3-(3-acetylphenyl)-1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-1-(furan-2-ylmethyl)urea Traditional Name: 3-(3-acetylphenyl)-1-[1-(3-cyanobenzyl)-4-piperidyl]-1-(2-furfuryl)urea Formula: C27H28N4O3 MolecularWeight: 456.53622

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N(CC2=CC=CO2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N(CC2=CC=CO2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H28N4O3/c1-20(32)23-7-3-8-24(16-23)29-27(33)31(19-26-9-4-14-34-26)25-10-12-30(13-11-25)18-22-6-2-5-21(15-22)17-28/h2-9,14-16,25H,10-13,18-19H2,1H3,(H,29,33)