N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(2-cyanophenyl)methylsulfanyl]-N-ethyl-ethanamide

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(2-cyanophenyl)methylsulfanyl]-N-ethyl-ethanamide Openeye Name: 2-[(2-cyanophenyl)methylsulfanyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethyl-acetamide CAS Name: 2-[(2-cyanophenyl)methylthio]-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-ethylacetamide IUPAC Name: 2-[(2-cyanophenyl)methylsulfanyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-N-ethylacetamide Traditional Name: 2-[(2-cyanobenzyl)thio]-N-[(3S)-1,1-diketothiolan-3-yl]-N-ethyl-acetamide Formula: C16H20N2O3S2 MolecularWeight: 352.4716

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C1CCS(=O)(=O)C1)C(=O)CSCC2=CC=CC=C2C#N

Isomeric SMILES

CCN([C@H]1CCS(=O)(=O)C1)C(=O)CSCC2=CC=CC=C2C#N

InChI

InChI=1S/C16H20N2O3S2/c1-2-18(15-7-8-23(20,21)12-15)16(19)11-22-10-14-6-4-3-5-13(14)9-17/h3-6,15H,2,7-8,10-12H2,1H3/t15-/m0/s1