2-[(3,5-dimethylphenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]ethanamide Openeye Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide CAS Name: 2-[(3,5-dimethylphenyl)methylthio]-N-[[4-(1-pyrrolidinyl)phenyl]methyl]acetamide IUPAC Name: 2-[(3,5-dimethylphenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylphenyl)methyl]acetamide Traditional Name: 2-[(3,5-dimethylbenzyl)thio]-N-(4-pyrrolidinobenzyl)acetamide Formula: C22H28N2OS MolecularWeight: 368.53552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)CSCC(=O)NCC2=CC=C(C=C2)N3CCCC3)C

Isomeric SMILES

CC1=CC(=CC(=C1)CSCC(=O)NCC2=CC=C(C=C2)N3CCCC3)C

InChI

InChI=1S/C22H28N2OS/c1-17-11-18(2)13-20(12-17)15-26-16-22(25)23-14-19-5-7-21(8-6-19)24-9-3-4-10-24/h5-8,11-13H,3-4,9-10,14-16H2,1-2H3,(H,23,25)