2-(4-methylphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]propanamide

Systemtic Name: 2-(4-methylphenyl)sulfanyl-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]propanamide Openeye Name: 2-(p-tolylsulfanyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide CAS Name: 2-[(4-methylphenyl)thio]-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]propanamide IUPAC Name: 2-(4-methylphenyl)sulfanyl-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]propanamide Traditional Name: 2-(p-tolylthio)-N-[4-(pyrrolidine-1-carbonyl)benzyl]propionamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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