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

Systemtic Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)ethanamide Openeye Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide CAS Name: 2-[(3-bromophenyl)methylthio]-N-[3-(1-pyrrolidinylsulfonyl)phenyl]acetamide IUPAC Name: 2-[(3-bromophenyl)methylsulfanyl]-N-(3-pyrrolidin-1-ylsulfonylphenyl)acetamide Traditional Name: 2-[(3-bromobenzyl)thio]-N-(3-pyrrolidinosulfonylphenyl)acetamide Formula: C19H21BrN2O3S2 MolecularWeight: 469.41564

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21BrN2O3S2/c20-16-6-3-5-15(11-16)13-26-14-19(23)21-17-7-4-8-18(12-17)27(24,25)22-9-1-2-10-22/h3-8,11-12H,1-2,9-10,13-14H2,(H,21,23)