2-(4-methylphenyl)sulfanyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]ethanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]ethanamide Openeye Name: 2-(p-tolylsulfanyl)-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide CAS Name: 2-[(4-methylphenyl)thio]-N-[[2-(1-pyrrolidinylmethyl)phenyl]methyl]acetamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[[2-(pyrrolidin-1-ylmethyl)phenyl]methyl]acetamide Traditional Name: 2-(p-tolylthio)-N-[2-(pyrrolidinomethyl)benzyl]acetamide Formula: C21H26N2OS MolecularWeight: 354.50894

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SCC(=O)NCC2=CC=CC=C2CN3CCCC3

Isomeric SMILES

CC1=CC=C(C=C1)SCC(=O)NCC2=CC=CC=C2CN3CCCC3

InChI

InChI=1S/C21H26N2OS/c1-17-8-10-20(11-9-17)25-16-21(24)22-14-18-6-2-3-7-19(18)15-23-12-4-5-13-23/h2-3,6-11H,4-5,12-16H2,1H3,(H,22,24)