3-(4-chlorophenyl)sulfanyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide

Systemtic Name: 3-(4-chlorophenyl)sulfanyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Openeye Name: 3-(4-chlorophenyl)sulfanyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide CAS Name: 3-[(4-chlorophenyl)thio]-N-[[4-(1-pyrrolidinylmethyl)phenyl]methyl]propanamide IUPAC Name: 3-(4-chlorophenyl)sulfanyl-N-[[4-(pyrrolidin-1-ylmethyl)phenyl]methyl]propanamide Traditional Name: 3-[(4-chlorophenyl)thio]-N-[4-(pyrrolidinomethyl)benzyl]propionamide Formula: C21H25ClN2OS MolecularWeight: 388.954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)CCSC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCN(C1)CC2=CC=C(C=C2)CNC(=O)CCSC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2OS/c22-19-7-9-20(10-8-19)26-14-11-21(25)23-15-17-3-5-18(6-4-17)16-24-12-1-2-13-24/h3-10H,1-2,11-16H2,(H,23,25)