1-phenyl-3-pyrrolidin-2-yl-3-sulfanyl-propan-1-one

Systemtic Name: 1-phenyl-3-pyrrolidin-2-yl-3-sulfanyl-propan-1-one Openeye Name: 1-phenyl-3-pyrrolidin-2-yl-3-sulfanyl-propan-1-one CAS Name: 3-mercapto-1-phenyl-3-(2-pyrrolidinyl)-1-propanone IUPAC Name: 1-phenyl-3-pyrrolidin-2-yl-3-sulfanylpropan-1-one Traditional Name: 3-mercapto-1-phenyl-3-pyrrolidin-2-yl-propan-1-one Formula: C13H17NOS MolecularWeight: 235.34518

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(NC1)C(CC(=O)C2=CC=CC=C2)S

Isomeric SMILES

C1CC(NC1)C(CC(=O)C2=CC=CC=C2)S

InChI

InChI=1S/C13H17NOS/c15-12(10-5-2-1-3-6-10)9-13(16)11-7-4-8-14-11/h1-3,5-6,11,13-14,16H,4,7-9H2