(phenylmethyl) 2-[3-(acetamidomethylsulfanyl)propanoyl]pyrazolidine-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[3-(acetamidomethylsulfanyl)propanoyl]pyrazolidine-1-carboxylate Openeye Name: benzyl 2-[3-(acetamidomethylsulfanyl)propanoyl]pyrazolidine-1-carboxylate CAS Name: 2-[3-(acetamidomethylthio)-1-oxopropyl]-1-pyrazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[3-(acetamidomethylsulfanyl)propanoyl]pyrazolidine-1-carboxylate Traditional Name: 2-[3-(acetamidomethylthio)propanoyl]pyrazolidine-1-carboxylic acid benzyl ester Formula: C17H23N3O4S MolecularWeight: 365.44722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NCSCCC(=O)N1CCCN1C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CC(=O)NCSCCC(=O)N1CCCN1C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C17H23N3O4S/c1-14(21)18-13-25-11-8-16(22)19-9-5-10-20(19)17(23)24-12-15-6-3-2-4-7-15/h2-4,6-7H,5,8-13H2,1H3,(H,18,21)