N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide

Systemtic Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)ethanamide Openeye Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(5-pyrrolidin-1-ylsulfonyl-2-thienyl)acetamide CAS Name: N-[2-[(2-cyanophenyl)methylthio]ethyl]-2-[5-(1-pyrrolidinylsulfonyl)-2-thiophenyl]acetamide IUPAC Name: N-[2-[(2-cyanophenyl)methylsulfanyl]ethyl]-2-(5-pyrrolidin-1-ylsulfonylthiophen-2-yl)acetamide Traditional Name: N-[2-[(2-cyanobenzyl)thio]ethyl]-2-(5-pyrrolidinosulfonyl-2-thienyl)acetamide Formula: C20H23N3O3S3 MolecularWeight: 449.60992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)NCCSCC3=CC=CC=C3C#N

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(S2)CC(=O)NCCSCC3=CC=CC=C3C#N

InChI

InChI=1S/C20H23N3O3S3/c21-14-16-5-1-2-6-17(16)15-27-12-9-22-19(24)13-18-7-8-20(28-18)29(25,26)23-10-3-4-11-23/h1-2,5-8H,3-4,9-13,15H2,(H,22,24)