N5-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide

Systemtic Name: N5-[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Openeye Name: N5-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide CAS Name: N5-[4-(2-oxo-1-pyrrolidinyl)phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide IUPAC Name: 5-N-[4-(2-oxopyrrolidin-1-yl)phenyl]-2-phenyl-3,4-dihydropyrazole-3,5-dicarboxamide Traditional Name: N-[4-(2-ketopyrrolidino)phenyl]-1-phenyl-2-pyrazoline-3,5-dicarboxamide Formula: C21H21N5O3 MolecularWeight: 391.42314

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)NC(=O)C3=NN(C(C3)C(=O)N)C4=CC=CC=C4

InChI

InChI=1S/C21H21N5O3/c22-20(28)18-13-17(24-26(18)16-5-2-1-3-6-16)21(29)23-14-8-10-15(11-9-14)25-12-4-7-19(25)27/h1-3,5-6,8-11,18H,4,7,12-13H2,(H2,22,28)(H,23,29)