(2S)-1-butyl-3,4-dimethyl-2-(phenylmethylsulfanyl)-2H-pyrrol-5-one

Systemtic Name: (2S)-1-butyl-3,4-dimethyl-2-(phenylmethylsulfanyl)-2H-pyrrol-5-one Openeye Name: (2S)-2-benzylsulfanyl-1-butyl-3,4-dimethyl-2H-pyrrol-5-one CAS Name: (2S)-1-butyl-3,4-dimethyl-2-(phenylmethylthio)-2H-pyrrol-5-one IUPAC Name: (2S)-2-benzylsulfanyl-1-butyl-3,4-dimethyl-2H-pyrrol-5-one Traditional Name: (5S)-5-(benzylthio)-1-butyl-3,4-dimethyl-3-pyrrolin-2-one Formula: C17H23NOS MolecularWeight: 289.43562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(C(=C(C1=O)C)C)SCC2=CC=CC=C2

Isomeric SMILES

CCCCN1[C@H](C(=C(C1=O)C)C)SCC2=CC=CC=C2

InChI

InChI=1S/C17H23NOS/c1-4-5-11-18-16(19)13(2)14(3)17(18)20-12-15-9-7-6-8-10-15/h6-10,17H,4-5,11-12H2,1-3H3/t17-/m0/s1