N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-(thiophen-3-ylmethylsulfanyl)benzamide

Systemtic Name: N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-(thiophen-3-ylmethylsulfanyl)benzamide Openeye Name: N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-(3-thienylmethylsulfanyl)benzamide CAS Name: N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]-2-(3-thiophenylmethylthio)benzamide IUPAC Name: N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]-2-(thiophen-3-ylmethylsulfanyl)benzamide Traditional Name: N-[2-(pyrrolidinomethyl)benzyl]-2-(3-thenylthio)benzamide Formula: C24H26N2OS2 MolecularWeight: 422.60604

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=CC=C2CNC(=O)C3=CC=CC=C3SCC4=CSC=C4

Isomeric SMILES

C1CCN(C1)CC2=CC=CC=C2CNC(=O)C3=CC=CC=C3SCC4=CSC=C4

InChI

InChI=1S/C24H26N2OS2/c27-24(22-9-3-4-10-23(22)29-18-19-11-14-28-17-19)25-15-20-7-1-2-8-21(20)16-26-12-5-6-13-26/h1-4,7-11,14,17H,5-6,12-13,15-16,18H2,(H,25,27)