1-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]-2-[2-(phenylsulfonyl)ethylsulfanyl]ethanone

Systemtic Name: 1-[2-(1-phenylcyclopropyl)carbonylpyrazolidin-1-yl]-2-[2-(phenylsulfonyl)ethylsulfanyl]ethanone Openeye Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-1-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethanone CAS Name: 2-[2-(benzenesulfonyl)ethylthio]-1-[2-[oxo-(1-phenylcyclopropyl)methyl]-1-pyrazolidinyl]ethanone IUPAC Name: 2-[2-(benzenesulfonyl)ethylsulfanyl]-1-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethanone Traditional Name: 2-(2-besylethylthio)-1-[2-(1-phenylcyclopropanecarbonyl)pyrazolidin-1-yl]ethanone Formula: C23H26N2O4S2 MolecularWeight: 458.59354

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(N(C1)C(=O)C2(CC2)C3=CC=CC=C3)C(=O)CSCCS(=O)(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(N(C1)C(=O)C2(CC2)C3=CC=CC=C3)C(=O)CSCCS(=O)(=O)C4=CC=CC=C4

InChI

InChI=1S/C23H26N2O4S2/c26-21(18-30-16-17-31(28,29)20-10-5-2-6-11-20)24-14-7-15-25(24)22(27)23(12-13-23)19-8-3-1-4-9-19/h1-6,8-11H,7,12-18H2