N-phenyl-7-[4-(5-sulfanylidene-1,2-dithiol-3-yl)phenoxy]heptanamide

Systemtic Name: N-phenyl-7-[4-(5-sulfanylidene-1,2-dithiol-3-yl)phenoxy]heptanamide Openeye Name: N-phenyl-7-[4-(5-thioxodithiol-3-yl)phenoxy]heptanamide CAS Name: N-phenyl-7-[4-(5-sulfanylidene-3-dithiolyl)phenoxy]heptanamide IUPAC Name: N-phenyl-7-[4-(5-sulfanylidenedithiol-3-yl)phenoxy]heptanamide Traditional Name: N-phenyl-7-[4-(5-thioxodithiol-3-yl)phenoxy]enanthamide Formula: C22H23NO2S3 MolecularWeight: 429.61852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)CCCCCCOC2=CC=C(C=C2)C3=CC(=S)SS3

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)CCCCCCOC2=CC=C(C=C2)C3=CC(=S)SS3

InChI

InChI=1S/C22H23NO2S3/c24-21(23-18-8-4-3-5-9-18)10-6-1-2-7-15-25-19-13-11-17(12-14-19)20-16-22(26)28-27-20/h3-5,8-9,11-14,16H,1-2,6-7,10,15H2,(H,23,24)