2-[(4-bromophenyl)methylsulfanyl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[(4-bromophenyl)methylsulfanyl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[(4-bromophenyl)methylsulfanyl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[(4-bromophenyl)methylthio]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[(4-bromophenyl)methylsulfanyl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[(4-bromobenzyl)thio]-1-pyrrolidino-ethanone Formula: C13H16BrNOS MolecularWeight: 314.24124

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CSCC2=CC=C(C=C2)Br

Isomeric SMILES

C1CCN(C1)C(=O)CSCC2=CC=C(C=C2)Br

InChI

InChI=1S/C13H16BrNOS/c14-12-5-3-11(4-6-12)9-17-10-13(16)15-7-1-2-8-15/h3-6H,1-2,7-10H2