3-[(4-chlorophenyl)methyl]-1-[2-(oxidanylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-thieno[2,3-b][1,4]thiazine-6-carboxylic acid

Systemtic Name: 3-[(4-chlorophenyl)methyl]-1-[2-(oxidanylamino)-2-oxidanylidene-ethyl]-2-oxidanylidene-thieno[2,3-b][1,4]thiazine-6-carboxylic acid Openeye Name: 3-[(4-chlorophenyl)methyl]-1-[2-(hydroxyamino)-2-oxo-ethyl]-2-oxo-thieno[2,3-b][1,4]thiazine-6-carboxylic acid CAS Name: 3-[(4-chlorophenyl)methyl]-1-[2-(hydroxyamino)-2-oxoethyl]-2-oxo-6-thieno[2,3-b][1,4]thiazinecarboxylic acid IUPAC Name: 3-[(4-chlorophenyl)methyl]-1-[2-(hydroxyamino)-2-oxoethyl]-2-oxothieno[2,3-b][1,4]thiazine-6-carboxylic acid Traditional Name: 3-(4-chlorobenzyl)-1-[2-(hydroxyamino)-2-keto-ethyl]-2-keto-thieno[2,3-b][1,4]thiazine-6-carboxylic acid Formula: C16H13ClN2O5S2 MolecularWeight: 412.86782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2C(=O)N(C3=C(S2)SC(=C3)C(=O)O)CC(=O)NO)Cl

Isomeric SMILES

C1=CC(=CC=C1CC2C(=O)N(C3=C(S2)SC(=C3)C(=O)O)CC(=O)NO)Cl

InChI

InChI=1S/C16H13ClN2O5S2/c17-9-3-1-8(2-4-9)5-11-14(21)19(7-13(20)18-24)10-6-12(15(22)23)26-16(10)25-11/h1-4,6,11,24H,5,7H2,(H,18,20)(H,22,23)