4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]benzenesulfonate

Systemtic Name: 4-[(2-azanyl-4-oxidanylidene-1,3-thiazol-5-ylidene)methyl]benzenesulfonate Openeye Name: 4-[(2-amino-4-oxo-thiazol-5-ylidene)methyl]benzenesulfonate CAS Name: 4-[(2-amino-4-oxo-5-thiazolylidene)methyl]benzenesulfonate IUPAC Name: 4-[(2-amino-4-oxo-1,3-thiazol-5-ylidene)methyl]benzenesulfonate Traditional Name: 4-[(2-amino-4-keto-2-thiazolin-5-ylidene)methyl]besylate Formula: C10H7N2O4S2- MolecularWeight: 283.30358

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=C2C(=O)N=C(S2)N)S(=O)(=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C=C2C(=O)N=C(S2)N)S(=O)(=O)[O-]

InChI

InChI=1S/C10H8N2O4S2/c11-10-12-9(13)8(17-10)5-6-1-3-7(4-2-6)18(14,15)16/h1-5H,(H2,11,12,13)(H,14,15,16)/p-1