N-[3-[4-[[1-(phenylmethyl)pyrazol-4-yl]methylamino]piperidin-1-yl]phenyl]pyridine-3-carboxamide

Systemtic Name: N-[3-[4-[[1-(phenylmethyl)pyrazol-4-yl]methylamino]piperidin-1-yl]phenyl]pyridine-3-carboxamide Openeye Name: N-[3-[4-[(1-benzylpyrazol-4-yl)methylamino]-1-piperidyl]phenyl]pyridine-3-carboxamide CAS Name: N-[3-[4-[[1-(phenylmethyl)-4-pyrazolyl]methylamino]-1-piperidinyl]phenyl]-3-pyridinecarboxamide IUPAC Name: N-[3-[4-[(1-benzylpyrazol-4-yl)methylamino]piperidin-1-yl]phenyl]pyridine-3-carboxamide Traditional Name: N-[3-[4-[(1-benzylpyrazol-4-yl)methylamino]piperidino]phenyl]nicotinamide Formula: C28H30N6O MolecularWeight: 466.5774

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NCC2=CN(N=C2)CC3=CC=CC=C3)C4=CC(=CC=C4)NC(=O)C5=CN=CC=C5

Isomeric SMILES

C1CN(CCC1NCC2=CN(N=C2)CC3=CC=CC=C3)C4=CC(=CC=C4)NC(=O)C5=CN=CC=C5

InChI

InChI=1S/C28H30N6O/c35-28(24-8-5-13-29-19-24)32-26-9-4-10-27(16-26)33-14-11-25(12-15-33)30-17-23-18-31-34(21-23)20-22-6-2-1-3-7-22/h1-10,13,16,18-19,21,25,30H,11-12,14-15,17,20H2,(H,32,35)