4-[(4-methylphenyl)sulfanylmethyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide

Systemtic Name: 4-[(4-methylphenyl)sulfanylmethyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide Openeye Name: 4-(p-tolylsulfanylmethyl)-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide CAS Name: 4-[[(4-methylphenyl)thio]methyl]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]benzamide IUPAC Name: 4-[(4-methylphenyl)sulfanylmethyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]benzamide Traditional Name: 4-[(p-tolylthio)methyl]-N-(4-pyrrolidinobenzyl)benzamide Formula: C26H28N2OS MolecularWeight: 416.57832

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4

Isomeric SMILES

CC1=CC=C(C=C1)SCC2=CC=C(C=C2)C(=O)NCC3=CC=C(C=C3)N4CCCC4

InChI

InChI=1S/C26H28N2OS/c1-20-4-14-25(15-5-20)30-19-22-6-10-23(11-7-22)26(29)27-18-21-8-12-24(13-9-21)28-16-2-3-17-28/h4-15H,2-3,16-19H2,1H3,(H,27,29)