5-[[3-(morpholin-4-ylamino)-4-oxidanyl-1,2-thiazol-5-yl]amino]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[[3-(morpholin-4-ylamino)-4-oxidanyl-1,2-thiazol-5-yl]amino]-2-oxidanyl-benzoic acid Openeye Name: 2-hydroxy-5-[[4-hydroxy-3-(morpholinoamino)isothiazol-5-yl]amino]benzoic acid CAS Name: 2-hydroxy-5-[[4-hydroxy-3-(4-morpholinylamino)-5-isothiazolyl]amino]benzoic acid IUPAC Name: 2-hydroxy-5-[[4-hydroxy-3-(morpholin-4-ylamino)-1,2-thiazol-5-yl]amino]benzoic acid Traditional Name: 2-hydroxy-5-[[4-hydroxy-3-(morpholinoamino)isothiazol-5-yl]amino]benzoic acid Formula: C14H16N4O5S MolecularWeight: 352.36564

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1NC2=NSC(=C2O)NC3=CC(=C(C=C3)O)C(=O)O

Isomeric SMILES

C1COCCN1NC2=NSC(=C2O)NC3=CC(=C(C=C3)O)C(=O)O

InChI

InChI=1S/C14H16N4O5S/c19-10-2-1-8(7-9(10)14(21)22)15-13-11(20)12(17-24-13)16-18-3-5-23-6-4-18/h1-2,7,15,19-20H,3-6H2,(H,16,17)(H,21,22)