5-phenyl-N-[4-[4-(2-pyrazol-1-ylethylamino)piperidin-1-yl]phenyl]pentanamide

Systemtic Name: 5-phenyl-N-[4-[4-(2-pyrazol-1-ylethylamino)piperidin-1-yl]phenyl]pentanamide Openeye Name: 5-phenyl-N-[4-[4-(2-pyrazol-1-ylethylamino)-1-piperidyl]phenyl]pentanamide CAS Name: 5-phenyl-N-[4-[4-[2-(1-pyrazolyl)ethylamino]-1-piperidinyl]phenyl]pentanamide IUPAC Name: 5-phenyl-N-[4-[4-(2-pyrazol-1-ylethylamino)piperidin-1-yl]phenyl]pentanamide Traditional Name: 5-phenyl-N-[4-[4-(2-pyrazol-1-ylethylamino)piperidino]phenyl]valeramide Formula: C27H35N5O MolecularWeight: 445.5997

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCCN2C=CC=N2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NCCN2C=CC=N2)C3=CC=C(C=C3)NC(=O)CCCCC4=CC=CC=C4

InChI

InChI=1S/C27H35N5O/c33-27(10-5-4-9-23-7-2-1-3-8-23)30-25-11-13-26(14-12-25)31-20-15-24(16-21-31)28-18-22-32-19-6-17-29-32/h1-3,6-8,11-14,17,19,24,28H,4-5,9-10,15-16,18,20-22H2,(H,30,33)