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

Systemtic Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(3,4-dichlorophenyl)methylthio]-N-[4-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3,4-dichlorophenyl)methylsulfanyl]-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3,4-dichlorobenzyl)thio]-N-(4-pyrrolidinosulfonylphenyl)acetamide Formula: C19H20Cl2N2O3S2 MolecularWeight: 459.4097

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20Cl2N2O3S2/c20-17-8-3-14(11-18(17)21)12-27-13-19(24)22-15-4-6-16(7-5-15)28(25,26)23-9-1-2-10-23/h3-8,11H,1-2,9-10,12-13H2,(H,22,24)