1-[4-(3-cyanophenyl)phenyl]-1-(1-cyclopentylpiperidin-4-yl)-3-(3-methoxyphenyl)urea

Systemtic Name: 1-[4-(3-cyanophenyl)phenyl]-1-(1-cyclopentylpiperidin-4-yl)-3-(3-methoxyphenyl)urea Openeye Name: 1-[4-(3-cyanophenyl)phenyl]-1-(1-cyclopentyl-4-piperidyl)-3-(3-methoxyphenyl)urea CAS Name: 1-[4-(3-cyanophenyl)phenyl]-1-(1-cyclopentyl-4-piperidinyl)-3-(3-methoxyphenyl)urea IUPAC Name: 1-[4-(3-cyanophenyl)phenyl]-1-(1-cyclopentylpiperidin-4-yl)-3-(3-methoxyphenyl)urea Traditional Name: 1-[4-(3-cyanophenyl)phenyl]-1-(1-cyclopentyl-4-piperidyl)-3-(3-methoxyphenyl)urea Formula: C31H34N4O2 MolecularWeight: 494.62726

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)NC(=O)N(C2CCN(CC2)C3CCCC3)C4=CC=C(C=C4)C5=CC=CC(=C5)C#N

Isomeric SMILES

COC1=CC=CC(=C1)NC(=O)N(C2CCN(CC2)C3CCCC3)C4=CC=C(C=C4)C5=CC=CC(=C5)C#N

InChI

InChI=1S/C31H34N4O2/c1-37-30-11-5-8-26(21-30)33-31(36)35(29-16-18-34(19-17-29)27-9-2-3-10-27)28-14-12-24(13-15-28)25-7-4-6-23(20-25)22-32/h4-8,11-15,20-21,27,29H,2-3,9-10,16-19H2,1H3,(H,33,36)