N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide

Systemtic Name: N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide Openeye Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-4-(2-thienylmethyl)piperazine-1-carboxamide CAS Name: N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]-4-(thiophen-2-ylmethyl)-1-piperazinecarboxamide IUPAC Name: N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]-4-(thiophen-2-ylmethyl)piperazine-1-carboxamide Traditional Name: N-[4-(2-ketopyrrolidino)benzyl]-4-(2-thenyl)piperazine-1-carboxamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)N3CCN(CC3)CC4=CC=CS4

Isomeric SMILES

C1CC(=O)N(C1)C2=CC=C(C=C2)CNC(=O)N3CCN(CC3)CC4=CC=CS4

InChI

InChI=1S/C21H26N4O2S/c26-20-4-1-9-25(20)18-7-5-17(6-8-18)15-22-21(27)24-12-10-23(11-13-24)16-19-3-2-14-28-19/h2-3,5-8,14H,1,4,9-13,15-16H2,(H,22,27)