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

Systemtic Name: 2-[(3-methylphenyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-(m-tolylmethylsulfanyl)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(3-methylphenyl)methylthio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3-methylphenyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-methylbenzyl)thio]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C20H24N2O3S2 MolecularWeight: 404.54616

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=CC(=CC=C1)CSCC(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C20H24N2O3S2/c1-16-5-4-6-17(13-16)14-26-15-20(23)21-18-7-9-19(10-8-18)27(24,25)22-11-2-3-12-22/h4-10,13H,2-3,11-12,14-15H2,1H3,(H,21,23)