3-[1,1,3,3-tetrakis(oxidanylidene)-5-phenyl-1,3-dithian-2-yl]propanamide

Systemtic Name: 3-[1,1,3,3-tetrakis(oxidanylidene)-5-phenyl-1,3-dithian-2-yl]propanamide Openeye Name: 3-(1,1,3,3-tetraoxo-5-phenyl-1,3-dithian-2-yl)propanamide CAS Name: 3-(1,1,3,3-tetraoxo-5-phenyl-1,3-dithian-2-yl)propanamide IUPAC Name: 3-(1,1,3,3-tetraoxo-5-phenyl-1,3-dithian-2-yl)propanamide Traditional Name: 3-(1,1,3,3-tetraketo-5-phenyl-1,3-dithian-2-yl)propionamide Formula: C13H17NO5S2 MolecularWeight: 331.40778

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CS(=O)(=O)C(S1(=O)=O)CCC(=O)N)C2=CC=CC=C2

Isomeric SMILES

C1C(CS(=O)(=O)C(S1(=O)=O)CCC(=O)N)C2=CC=CC=C2

InChI

InChI=1S/C13H17NO5S2/c14-12(15)6-7-13-20(16,17)8-11(9-21(13,18)19)10-4-2-1-3-5-10/h1-5,11,13H,6-9H2,(H2,14,15)