N-[3-[4-[(1-ethylpyrazol-4-yl)methylamino]piperidin-1-yl]phenyl]-4-phenyl-butanamide

Systemtic Name: N-[3-[4-[(1-ethylpyrazol-4-yl)methylamino]piperidin-1-yl]phenyl]-4-phenyl-butanamide Openeye Name: N-[3-[4-[(1-ethylpyrazol-4-yl)methylamino]-1-piperidyl]phenyl]-4-phenyl-butanamide CAS Name: N-[3-[4-[(1-ethyl-4-pyrazolyl)methylamino]-1-piperidinyl]phenyl]-4-phenylbutanamide IUPAC Name: N-[3-[4-[(1-ethylpyrazol-4-yl)methylamino]piperidin-1-yl]phenyl]-4-phenylbutanamide Traditional Name: N-[3-[4-[(1-ethylpyrazol-4-yl)methylamino]piperidino]phenyl]-4-phenyl-butyramide Formula: C27H35N5O MolecularWeight: 445.5997

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)CNC2CCN(CC2)C3=CC(=CC=C3)NC(=O)CCCC4=CC=CC=C4

Isomeric SMILES

CCN1C=C(C=N1)CNC2CCN(CC2)C3=CC(=CC=C3)NC(=O)CCCC4=CC=CC=C4

InChI

InChI=1S/C27H35N5O/c1-2-32-21-23(20-29-32)19-28-24-14-16-31(17-15-24)26-12-7-11-25(18-26)30-27(33)13-6-10-22-8-4-3-5-9-22/h3-5,7-9,11-12,18,20-21,24,28H,2,6,10,13-17,19H2,1H3,(H,30,33)