(3E)-3-ethylidene-4-[2-(phenylmethylsulfanyl)propan-2-yl]pyrrolidin-2-one

Systemtic Name: (3E)-3-ethylidene-4-[2-(phenylmethylsulfanyl)propan-2-yl]pyrrolidin-2-one Openeye Name: (3E)-4-(1-benzylsulfanyl-1-methyl-ethyl)-3-ethylidene-pyrrolidin-2-one CAS Name: (3E)-3-ethylidene-4-[2-(phenylmethylthio)propan-2-yl]-2-pyrrolidinone IUPAC Name: (3E)-4-(2-benzylsulfanylpropan-2-yl)-3-ethylidenepyrrolidin-2-one Traditional Name: (3E)-4-[1-(benzylthio)-1-methyl-ethyl]-3-ethylidene-2-pyrrolidone Formula: C16H21NOS MolecularWeight: 275.40904

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Descriptors Computed from Structure

Canonical SMILES:

CC=C1C(CNC1=O)C(C)(C)SCC2=CC=CC=C2

Isomeric SMILES

C/C=C/1\C(CNC1=O)C(C)(C)SCC2=CC=CC=C2

InChI

InChI=1S/C16H21NOS/c1-4-13-14(10-17-15(13)18)16(2,3)19-11-12-8-6-5-7-9-12/h4-9,14H,10-11H2,1-3H3,(H,17,18)/b13-4+