[3-(aminocarbonylamino)-2-(2,4-dichlorophenyl)carbonyl-1-benzofuran-6-yl] 5-pyridin-2-ylthiophene-2-sulfonate

Systemtic Name: [3-(aminocarbonylamino)-2-(2,4-dichlorophenyl)carbonyl-1-benzofuran-6-yl] 5-pyridin-2-ylthiophene-2-sulfonate Openeye Name: [2-(2,4-dichlorobenzoyl)-3-ureido-benzofuran-6-yl] 5-(2-pyridyl)thiophene-2-sulfonate CAS Name: 5-(2-pyridinyl)-2-thiophenesulfonic acid [3-(carbamoylamino)-2-[(2,4-dichlorophenyl)-oxomethyl]-6-benzofuranyl] ester IUPAC Name: [3-(carbamoylamino)-2-(2,4-dichlorobenzoyl)-1-benzofuran-6-yl] 5-pyridin-2-ylthiophene-2-sulfonate Traditional Name: 5-(2-pyridyl)thiophene-2-sulfonic acid [2-(2,4-dichlorobenzoyl)-3-ureido-benzofuran-6-yl] ester Formula: C25H15Cl2N3O6S2 MolecularWeight: 588.4391

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=NC(=C1)C2=CC=C(S2)S(=O)(=O)OC3=CC4=C(C=C3)C(=C(O4)C(=O)C5=C(C=C(C=C5)Cl)Cl)NC(=O)N

Isomeric SMILES

C1=CC=NC(=C1)C2=CC=C(S2)S(=O)(=O)OC3=CC4=C(C=C3)C(=C(O4)C(=O)C5=C(C=C(C=C5)Cl)Cl)NC(=O)N

InChI

InChI=1S/C25H15Cl2N3O6S2/c26-13-4-6-15(17(27)11-13)23(31)24-22(30-25(28)32)16-7-5-14(12-19(16)35-24)36-38(33,34)21-9-8-20(37-21)18-3-1-2-10-29-18/h1-12H,(H3,28,30,32)