3-(aminocarbonylamino)-5-(4-fluorophenyl)thiophene-2-sulfonic acid

Systemtic Name: 3-(aminocarbonylamino)-5-(4-fluorophenyl)thiophene-2-sulfonic acid Openeye Name: 5-(4-fluorophenyl)-3-ureido-thiophene-2-sulfonic acid CAS Name: 3-(carbamoylamino)-5-(4-fluorophenyl)-2-thiophenesulfonic acid IUPAC Name: 3-(carbamoylamino)-5-(4-fluorophenyl)thiophene-2-sulfonic acid Traditional Name: 5-(4-fluorophenyl)-3-ureido-thiophene-2-sulfonic acid Formula: C11H9FN2O4S2 MolecularWeight: 316.328563

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=C(S2)S(=O)(=O)O)NC(=O)N)F

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=C(S2)S(=O)(=O)O)NC(=O)N)F

InChI

InChI=1S/C11H9FN2O4S2/c12-7-3-1-6(2-4-7)9-5-8(14-11(13)15)10(19-9)20(16,17)18/h1-5H,(H3,13,14,15)(H,16,17,18)