N'-(4-chlorophenyl)sulfonyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-fluoranyl-benzenecarboximidamide

Systemtic Name: N'-(4-chlorophenyl)sulfonyl-N-(6-ethanoyl-1,3-benzodioxol-5-yl)-4-fluoranyl-benzenecarboximidamide Openeye Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-N'-(4-chlorophenyl)sulfonyl-4-fluoro-benzamidine CAS Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-N'-(4-chlorophenyl)sulfonyl-4-fluorobenzenecarboximidamide IUPAC Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-N'-(4-chlorophenyl)sulfonyl-4-fluorobenzenecarboximidamide Traditional Name: N-(6-acetyl-1,3-benzodioxol-5-yl)-N'-(4-chlorophenyl)sulfonyl-4-fluoro-benzamidine Formula: C22H16ClFN2O5S MolecularWeight: 474.889243

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1NC(=NS(=O)(=O)C3=CC=C(C=C3)Cl)C4=CC=C(C=C4)F)OCO2

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1N/C(=N/S(=O)(=O)C3=CC=C(C=C3)Cl)/C4=CC=C(C=C4)F)OCO2

InChI

InChI=1S/C22H16ClFN2O5S/c1-13(27)18-10-20-21(31-12-30-20)11-19(18)25-22(14-2-6-16(24)7-3-14)26-32(28,29)17-8-4-15(23)5-9-17/h2-11H,12H2,1H3,(H,25,26)