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

Systemtic Name: 3-(2-methoxyphenyl)-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-1-(phenylmethyl)pyrazole-4-carboxamide Openeye Name: 1-benzyl-3-(2-methoxyphenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyrazole-4-carboxamide CAS Name: 3-(2-methoxyphenyl)-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-1-(phenylmethyl)-4-pyrazolecarboxamide IUPAC Name: 1-benzyl-3-(2-methoxyphenyl)-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]pyrazole-4-carboxamide Traditional Name: 1-benzyl-N-[4-(2-ketopyrrolidino)benzyl]-3-(2-methoxyphenyl)pyrazole-4-carboxamide Formula: C29H28N4O3 MolecularWeight: 480.55762

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCC3=CC=C(C=C3)N4CCCC4=O)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=CC=C1C2=NN(C=C2C(=O)NCC3=CC=C(C=C3)N4CCCC4=O)CC5=CC=CC=C5

InChI

InChI=1S/C29H28N4O3/c1-36-26-11-6-5-10-24(26)28-25(20-32(31-28)19-22-8-3-2-4-9-22)29(35)30-18-21-13-15-23(16-14-21)33-17-7-12-27(33)34/h2-6,8-11,13-16,20H,7,12,17-19H2,1H3,(H,30,35)