5-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]-2-methoxy-4-methyl-benzoic acid

Systemtic Name: 5-[(2-azanyl-1,3-thiazol-5-yl)sulfanyl]-2-methoxy-4-methyl-benzoic acid Openeye Name: 5-(2-aminothiazol-5-yl)sulfanyl-2-methoxy-4-methyl-benzoic acid CAS Name: 5-[(2-amino-5-thiazolyl)thio]-2-methoxy-4-methylbenzoic acid IUPAC Name: 5-[(2-amino-1,3-thiazol-5-yl)sulfanyl]-2-methoxy-4-methylbenzoic acid Traditional Name: 5-[(2-aminothiazol-5-yl)thio]-2-methoxy-4-methyl-benzoic acid Formula: C12H12N2O3S2 MolecularWeight: 296.36528

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C(=C1)OC)C(=O)O)SC2=CN=C(S2)N

Isomeric SMILES

CC1=C(C=C(C(=C1)OC)C(=O)O)SC2=CN=C(S2)N

InChI

InChI=1S/C12H12N2O3S2/c1-6-3-8(17-2)7(11(15)16)4-9(6)18-10-5-14-12(13)19-10/h3-5H,1-2H3,(H2,13,14)(H,15,16)