3-(3,4-dimethylphenyl)sulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide

Systemtic Name: 3-(3,4-dimethylphenyl)sulfanyl-N-[[4-(2-oxidanylidenepyrrolidin-1-yl)phenyl]methyl]propanamide Openeye Name: 3-(3,4-dimethylphenyl)sulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide CAS Name: 3-[(3,4-dimethylphenyl)thio]-N-[[4-(2-oxo-1-pyrrolidinyl)phenyl]methyl]propanamide IUPAC Name: 3-(3,4-dimethylphenyl)sulfanyl-N-[[4-(2-oxopyrrolidin-1-yl)phenyl]methyl]propanamide Traditional Name: 3-[(3,4-dimethylphenyl)thio]-N-[4-(2-ketopyrrolidino)benzyl]propionamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2S/c1-16-5-10-20(14-17(16)2)27-13-11-21(25)23-15-18-6-8-19(9-7-18)24-12-3-4-22(24)26/h5-10,14H,3-4,11-13,15H2,1-2H3,(H,23,25)