S-[1-methyl-5-[(2-oxidanylideneimidazolidin-1-yl)methyl]pyrrolidin-3-yl] ethanethioate

Systemtic Name: S-[1-methyl-5-[(2-oxidanylideneimidazolidin-1-yl)methyl]pyrrolidin-3-yl] ethanethioate Openeye Name: S-[1-methyl-5-[(2-oxoimidazolidin-1-yl)methyl]pyrrolidin-3-yl] ethanethioate CAS Name: ethanethioic acid S-[1-methyl-5-[(2-oxo-1-imidazolidinyl)methyl]-3-pyrrolidinyl] ester IUPAC Name: S-[1-methyl-5-[(2-oxoimidazolidin-1-yl)methyl]pyrrolidin-3-yl] ethanethioate Traditional Name: ethanethioic acid S-[5-[(2-ketoimidazolidin-1-yl)methyl]-1-methyl-pyrrolidin-3-yl] ester Formula: C11H19N3O2S MolecularWeight: 257.35246

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SC1CC(N(C1)C)CN2CCNC2=O

Isomeric SMILES

CC(=O)SC1CC(N(C1)C)CN2CCNC2=O

InChI

InChI=1S/C11H19N3O2S/c1-8(15)17-10-5-9(13(2)7-10)6-14-4-3-12-11(14)16/h9-10H,3-7H2,1-2H3,(H,12,16)