2-(4-chlorophenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide

Systemtic Name: 2-(4-chlorophenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide Openeye Name: 2-(4-chlorophenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide CAS Name: 2-[(4-chlorophenyl)thio]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]butanamide IUPAC Name: 2-(4-chlorophenyl)sulfanyl-N-[(4-pyrrolidin-1-ylphenyl)methyl]butanamide Traditional Name: 2-[(4-chlorophenyl)thio]-N-(4-pyrrolidinobenzyl)butyramide Formula: C21H25ClN2OS MolecularWeight: 388.954

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)SC3=CC=C(C=C3)Cl

Isomeric SMILES

CCC(C(=O)NCC1=CC=C(C=C1)N2CCCC2)SC3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H25ClN2OS/c1-2-20(26-19-11-7-17(22)8-12-19)21(25)23-15-16-5-9-18(10-6-16)24-13-3-4-14-24/h5-12,20H,2-4,13-15H2,1H3,(H,23,25)