2-[(3-methylphenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide

Systemtic Name: 2-[(3-methylphenyl)methylsulfanyl]-N-[(4-pyrrolidin-1-ylcarbonylphenyl)methyl]ethanamide Openeye Name: 2-(m-tolylmethylsulfanyl)-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide CAS Name: 2-[(3-methylphenyl)methylthio]-N-[[4-[oxo(1-pyrrolidinyl)methyl]phenyl]methyl]acetamide IUPAC Name: 2-[(3-methylphenyl)methylsulfanyl]-N-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]acetamide Traditional Name: 2-[(3-methylbenzyl)thio]-N-[4-(pyrrolidine-1-carbonyl)benzyl]acetamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N2O2S/c1-17-5-4-6-19(13-17)15-27-16-21(25)23-14-18-7-9-20(10-8-18)22(26)24-11-2-3-12-24/h4-10,13H,2-3,11-12,14-16H2,1H3,(H,23,25)