1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-1-(furan-2-ylmethyl)-3-(2-methoxy-5-methyl-phenyl)urea

Systemtic Name: 1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-1-(furan-2-ylmethyl)-3-(2-methoxy-5-methyl-phenyl)urea Openeye Name: 1-[1-[(3-cyanophenyl)methyl]-4-piperidyl]-1-(2-furylmethyl)-3-(2-methoxy-5-methyl-phenyl)urea CAS Name: 1-[1-[(3-cyanophenyl)methyl]-4-piperidinyl]-1-(2-furanylmethyl)-3-(2-methoxy-5-methylphenyl)urea IUPAC Name: 1-[1-[(3-cyanophenyl)methyl]piperidin-4-yl]-1-(furan-2-ylmethyl)-3-(2-methoxy-5-methylphenyl)urea Traditional Name: 1-[1-(3-cyanobenzyl)-4-piperidyl]-1-(2-furfuryl)-3-(2-methoxy-5-methyl-phenyl)urea Formula: C27H30N4O3 MolecularWeight: 458.5521

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CC=CO2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

Isomeric SMILES

CC1=CC(=C(C=C1)OC)NC(=O)N(CC2=CC=CO2)C3CCN(CC3)CC4=CC=CC(=C4)C#N

InChI

InChI=1S/C27H30N4O3/c1-20-8-9-26(33-2)25(15-20)29-27(32)31(19-24-7-4-14-34-24)23-10-12-30(13-11-23)18-22-6-3-5-21(16-22)17-28/h3-9,14-16,23H,10-13,18-19H2,1-2H3,(H,29,32)