[2-(phenylmethylsulfanyl)pyridin-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [2-(phenylmethylsulfanyl)pyridin-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: (2-benzylsulfanyl-3-pyridyl)-pyrrolidin-1-yl-methanone CAS Name: [2-(phenylmethylthio)-3-pyridinyl]-(1-pyrrolidinyl)methanone IUPAC Name: (2-benzylsulfanylpyridin-3-yl)-pyrrolidin-1-ylmethanone Traditional Name: [2-(benzylthio)-3-pyridyl]-pyrrolidino-methanone Formula: C17H18N2OS MolecularWeight: 298.40262

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

Isomeric SMILES

C1CCN(C1)C(=O)C2=C(N=CC=C2)SCC3=CC=CC=C3

InChI

InChI=1S/C17H18N2OS/c20-17(19-11-4-5-12-19)15-9-6-10-18-16(15)21-13-14-7-2-1-3-8-14/h1-3,6-10H,4-5,11-13H2