3-(phenylmethylsulfanyl)-1-pyrrolidin-1-yl-propan-1-one

Systemtic Name: 3-(phenylmethylsulfanyl)-1-pyrrolidin-1-yl-propan-1-one Openeye Name: 3-benzylsulfanyl-1-pyrrolidin-1-yl-propan-1-one CAS Name: 3-(phenylmethylthio)-1-(1-pyrrolidinyl)-1-propanone IUPAC Name: 3-benzylsulfanyl-1-pyrrolidin-1-ylpropan-1-one Traditional Name: 3-(benzylthio)-1-pyrrolidino-propan-1-one Formula: C14H19NOS MolecularWeight: 249.37176

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CCSCC2=CC=CC=C2

Isomeric SMILES

C1CCN(C1)C(=O)CCSCC2=CC=CC=C2

InChI

InChI=1S/C14H19NOS/c16-14(15-9-4-5-10-15)8-11-17-12-13-6-2-1-3-7-13/h1-3,6-7H,4-5,8-12H2