1-[2-(4-cyano-2,6-dimethyl-pyridin-3-yl)phenyl]-3-[1-(4-phenylpiperidin-1-yl)propyl]urea

Systemtic Name: 1-[2-(4-cyano-2,6-dimethyl-pyridin-3-yl)phenyl]-3-[1-(4-phenylpiperidin-1-yl)propyl]urea Openeye Name: 1-[2-(4-cyano-2,6-dimethyl-3-pyridyl)phenyl]-3-[1-(4-phenyl-1-piperidyl)propyl]urea CAS Name: 1-[2-(4-cyano-2,6-dimethyl-3-pyridinyl)phenyl]-3-[1-(4-phenyl-1-piperidinyl)propyl]urea IUPAC Name: 1-[2-(4-cyano-2,6-dimethylpyridin-3-yl)phenyl]-3-[1-(4-phenylpiperidin-1-yl)propyl]urea Traditional Name: 1-[2-(4-cyano-2,6-dimethyl-3-pyridyl)phenyl]-3-[1-(4-phenylpiperidino)propyl]urea Formula: C29H33N5O MolecularWeight: 467.60522

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Descriptors Computed from Structure

Canonical SMILES:

CCC(NC(=O)NC1=CC=CC=C1C2=C(N=C(C=C2C#N)C)C)N3CCC(CC3)C4=CC=CC=C4

Isomeric SMILES

CCC(NC(=O)NC1=CC=CC=C1C2=C(N=C(C=C2C#N)C)C)N3CCC(CC3)C4=CC=CC=C4

InChI

InChI=1S/C29H33N5O/c1-4-27(34-16-14-23(15-17-34)22-10-6-5-7-11-22)33-29(35)32-26-13-9-8-12-25(26)28-21(3)31-20(2)18-24(28)19-30/h5-13,18,23,27H,4,14-17H2,1-3H3,(H2,32,33,35)