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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(3-cyanophenyl)methylsulfanyl]-N-phenyl-ethanamide Openeye Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-N-phenyl-acetamide CAS Name: 2-[(3-cyanophenyl)methylthio]-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-phenylacetamide IUPAC Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-N-phenylacetamide Traditional Name: 2-[(3-cyanobenzyl)thio]-N-[(3S)-1,1-diketothiolan-3-yl]-N-phenyl-acetamide Formula: C20H20N2O3S2 MolecularWeight: 400.5144

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1N(C2=CC=CC=C2)C(=O)CSCC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CS(=O)(=O)C[C@H]1N(C2=CC=CC=C2)C(=O)CSCC3=CC=CC(=C3)C#N

InChI

InChI=1S/C20H20N2O3S2/c21-12-16-5-4-6-17(11-16)13-26-14-20(23)22(18-7-2-1-3-8-18)19-9-10-27(24,25)15-19/h1-8,11,19H,9-10,13-15H2/t19-/m0/s1