(phenylmethyl) 2-(2-pyridin-2-ylsulfanylethanoyl)pyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-(2-pyridin-2-ylsulfanylethanoyl)pyrazolidine-1-carboxylate Openeye Name: benzyl 2-[2-(2-pyridylsulfanyl)acetyl]pyrazolidine-1-carboxylate CAS Name: 2-[1-oxo-2-(2-pyridinylthio)ethyl]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-(2-pyridin-2-ylsulfanylacetyl)pyrazolidine-1-carboxylate Traditional Name: 2-[2-(2-pyridylthio)acetyl]pyrazolidine-1-carboxylic acid benzyl ester Formula: C18H19N3O3S MolecularWeight: 357.42676

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)CSC3=CC=CC=N3

Isomeric SMILES

C1CN(N(C1)C(=O)OCC2=CC=CC=C2)C(=O)CSC3=CC=CC=N3

InChI

InChI=1S/C18H19N3O3S/c22-17(14-25-16-9-4-5-10-19-16)20-11-6-12-21(20)18(23)24-13-15-7-2-1-3-8-15/h1-5,7-10H,6,11-14H2