4-[5-(4-sulfanylphenyl)spiro[2.4]hepta-4,6-dien-6-yl]benzenesulfonamide

Systemtic Name: 4-[5-(4-sulfanylphenyl)spiro[2.4]hepta-4,6-dien-6-yl]benzenesulfonamide Openeye Name: 4-[5-(4-sulfanylphenyl)spiro[2.4]hepta-4,6-dien-6-yl]benzenesulfonamide CAS Name: 4-[5-(4-mercaptophenyl)-6-spiro[2.4]hepta-4,6-dienyl]benzenesulfonamide IUPAC Name: 4-[5-(4-sulfanylphenyl)spiro[2.4]hepta-4,6-dien-6-yl]benzenesulfonamide Traditional Name: 4-[5-(4-mercaptophenyl)spiro[2.4]hepta-4,6-dien-6-yl]benzenesulfonamide Formula: C19H17NO2S2 MolecularWeight: 355.47378

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC12C=C(C(=C2)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)S

Isomeric SMILES

C1CC12C=C(C(=C2)C3=CC=C(C=C3)S(=O)(=O)N)C4=CC=C(C=C4)S

InChI

InChI=1S/C19H17NO2S2/c20-24(21,22)16-7-3-14(4-8-16)18-12-19(9-10-19)11-17(18)13-1-5-15(23)6-2-13/h1-8,11-12,23H,9-10H2,(H2,20,21,22)