2-[(3-chlorophenyl)methylsulfanyl]-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]ethanamide

Systemtic Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]ethanamide Openeye Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[(5-pyrrolidin-1-ylsulfonyl-2-thienyl)methyl]acetamide CAS Name: 2-[(3-chlorophenyl)methylthio]-N-[[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]methyl]acetamide IUPAC Name: 2-[(3-chlorophenyl)methylsulfanyl]-N-[(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)methyl]acetamide Traditional Name: 2-[(3-chlorobenzyl)thio]-N-[(5-pyrrolidinosulfonyl-2-thienyl)methyl]acetamide Formula: C18H21ClN2O3S3 MolecularWeight: 445.01894

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)CSCC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CNC(=O)CSCC3=CC(=CC=C3)Cl

InChI

InChI=1S/C18H21ClN2O3S3/c19-15-5-3-4-14(10-15)12-25-13-17(22)20-11-16-6-7-18(26-16)27(23,24)21-8-1-2-9-21/h3-7,10H,1-2,8-9,11-13H2,(H,20,22)