disodium 4-[(4-chlorophenyl)carbamoyl]-1,2-thiazole-3,5-dithiolate

Systemtic Name: disodium 4-[(4-chlorophenyl)carbamoyl]-1,2-thiazole-3,5-dithiolate Openeye Name: disodium 4-[(4-chlorophenyl)carbamoyl]isothiazole-3,5-dithiolate CAS Name: disodium 4-[(4-chloroanilino)-oxomethyl]isothiazole-3,5-dithiolate IUPAC Name: disodium 4-[(4-chlorophenyl)carbamoyl]-1,2-thiazole-3,5-dithiolate Traditional Name: disodium 4-[(4-chlorophenyl)carbamoyl]isothiazole-3,5-dithiolate Formula: C10H5ClN2Na2OS3 MolecularWeight: 346.78704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=O)C2=C(SN=C2[S-])[S-])Cl.[Na+].[Na+]

Isomeric SMILES

C1=CC(=CC=C1NC(=O)C2=C(SN=C2[S-])[S-])Cl.[Na+].[Na+]

InChI

InChI=1S/C10H7ClN2OS3.2Na/c11-5-1-3-6(4-2-5)12-8(14)7-9(15)13-17-10(7)16;;/h1-4,16H,(H,12,14)(H,13,15);;/q;2*+1/p-2