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

Systemtic Name: N-[(3S)-1,1-bis(oxidanylidene)thiolan-3-yl]-2-[(3-cyanophenyl)methylsulfanyl]-N-propyl-ethanamide Openeye Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-N-propyl-acetamide CAS Name: 2-[(3-cyanophenyl)methylthio]-N-[(3S)-1,1-dioxo-3-thiolanyl]-N-propylacetamide IUPAC Name: 2-[(3-cyanophenyl)methylsulfanyl]-N-[(3S)-1,1-dioxothiolan-3-yl]-N-propylacetamide Traditional Name: 2-[(3-cyanobenzyl)thio]-N-[(3S)-1,1-diketothiolan-3-yl]-N-propyl-acetamide Formula: C17H22N2O3S2 MolecularWeight: 366.49818

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1CCS(=O)(=O)C1)C(=O)CSCC2=CC=CC(=C2)C#N

Isomeric SMILES

CCCN([C@H]1CCS(=O)(=O)C1)C(=O)CSCC2=CC=CC(=C2)C#N

InChI

InChI=1S/C17H22N2O3S2/c1-2-7-19(16-6-8-24(21,22)13-16)17(20)12-23-11-15-5-3-4-14(9-15)10-18/h3-5,9,16H,2,6-8,11-13H2,1H3/t16-/m0/s1