(1S,2R,8S)-1-methyl-2-phenylsulfanyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one

Systemtic Name: (1S,2R,8S)-1-methyl-2-phenylsulfanyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one Openeye Name: (1S,2R,8S)-1-methyl-2-phenylsulfanyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one CAS Name: (1S,2R,8S)-1-methyl-2-(phenylthio)-1,2,5,6,7,8-hexahydropyrrolizin-3-one IUPAC Name: (1S,2R,8S)-1-methyl-2-phenylsulfanyl-1,2,5,6,7,8-hexahydropyrrolizin-3-one Traditional Name: (1S,2R,8S)-1-methyl-2-(phenylthio)pyrrolizidin-3-one Formula: C14H17NOS MolecularWeight: 247.35588

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2CCCN2C(=O)C1SC3=CC=CC=C3

Isomeric SMILES

C[C@H]1[C@@H]2CCCN2C(=O)[C@@H]1SC3=CC=CC=C3

InChI

InChI=1S/C14H17NOS/c1-10-12-8-5-9-15(12)14(16)13(10)17-11-6-3-2-4-7-11/h2-4,6-7,10,12-13H,5,8-9H2,1H3/t10-,12-,13+/m0/s1