2-(2,5-dimethylphenyl)sulfanyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)ethanamide

Systemtic Name: 2-(2,5-dimethylphenyl)sulfanyl-N-(4-pyrrolidin-1-ylcarbonylphenyl)ethanamide Openeye Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide CAS Name: 2-[(2,5-dimethylphenyl)thio]-N-[4-[oxo(1-pyrrolidinyl)methyl]phenyl]acetamide IUPAC Name: 2-(2,5-dimethylphenyl)sulfanyl-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide Traditional Name: 2-[(2,5-dimethylphenyl)thio]-N-[4-(pyrrolidine-1-carbonyl)phenyl]acetamide Formula: C21H24N2O2S MolecularWeight: 368.49246

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=C(C=C1)C)SCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCC3

InChI

InChI=1S/C21H24N2O2S/c1-15-5-6-16(2)19(13-15)26-14-20(24)22-18-9-7-17(8-10-18)21(25)23-11-3-4-12-23/h5-10,13H,3-4,11-12,14H2,1-2H3,(H,22,24)