3-(methylsulfinylmethyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide

Systemtic Name: 3-(methylsulfinylmethyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Openeye Name: 3-(methylsulfinylmethyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide CAS Name: 3-(methylsulfinylmethyl)-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]benzamide IUPAC Name: 3-(methylsulfinylmethyl)-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]benzamide Traditional Name: 3-(methylsulfinylmethyl)-N-[4-(pyrrolidinomethyl)benzyl]benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)CC1=CC=CC(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCC3

Isomeric SMILES

CS(=O)CC1=CC=CC(=C1)C(=O)NCC2=CC=C(C=C2)CN3CCCC3

InChI

InChI=1S/C21H26N2O2S/c1-26(25)16-19-5-4-6-20(13-19)21(24)22-14-17-7-9-18(10-8-17)15-23-11-2-3-12-23/h4-10,13H,2-3,11-12,14-16H2,1H3,(H,22,24)