1-phenyl-2-(3-sulfanylpyrrolidin-1-yl)propan-1-one

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=CC=C1)N2CCC(C2)S

Isomeric SMILES

CC(C(=O)C1=CC=CC=C1)N2CCC(C2)S

InChI

InChI=1S/C13H17NOS/c1-10(14-8-7-12(16)9-14)13(15)11-5-3-2-4-6-11/h2-6,10,12,16H,7-9H2,1H3