4-[1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-2-one

Systemtic Name: 4-[1-(3-methylsulfanylphenyl)-5-oxidanylidene-pyrrolidin-3-yl]carbonylpiperazin-2-one Openeye Name: 4-[1-(3-methylsulfanylphenyl)-5-oxo-pyrrolidine-3-carbonyl]piperazin-2-one CAS Name: 4-[[1-[3-(methylthio)phenyl]-5-oxo-3-pyrrolidinyl]-oxomethyl]-2-piperazinone IUPAC Name: 4-[1-(3-methylsulfanylphenyl)-5-oxopyrrolidine-3-carbonyl]piperazin-2-one Traditional Name: 4-[5-keto-1-[3-(methylthio)phenyl]pyrrolidine-3-carbonyl]piperazin-2-one Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCNC(=O)C3

Isomeric SMILES

CSC1=CC=CC(=C1)N2CC(CC2=O)C(=O)N3CCNC(=O)C3

InChI

InChI=1S/C16H19N3O3S/c1-23-13-4-2-3-12(8-13)19-9-11(7-15(19)21)16(22)18-6-5-17-14(20)10-18/h2-4,8,11H,5-7,9-10H2,1H3,(H,17,20)