N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide

Systemtic Name: N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-1-(phenylmethyl)-3-pyridin-3-yl-pyrazole-4-carboxamide Openeye Name: 1-benzyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-3-(3-pyridyl)pyrazole-4-carboxamide CAS Name: N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-1-(phenylmethyl)-3-(3-pyridinyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-3-pyridin-3-ylpyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[4-(2-ketopyrrolidino)benzyl]-3-(3-pyridyl)pyrazole-4-carboxamide Formula: C27H25N5O2 MolecularWeight: 451.5197

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)C3=CN(N=C3C4=CN=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C27H25N5O2/c33-25-9-5-15-32(25)23-12-10-20(11-13-23)16-29-27(34)24-19-31(18-21-6-2-1-3-7-21)30-26(24)22-8-4-14-28-17-22/h1-4,6-8,10-14,17,19H,5,9,15-16,18H2,(H,29,34)