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

Systemtic Name: 5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-2-nitro-benzoic acid Openeye Name: 5-(4-methylthiazol-2-yl)sulfanyl-2-nitro-benzoic acid CAS Name: 5-[(4-methyl-2-thiazolyl)thio]-2-nitrobenzoic acid IUPAC Name: 5-[(4-methyl-1,3-thiazol-2-yl)sulfanyl]-2-nitrobenzoic acid Traditional Name: 5-[(4-methylthiazol-2-yl)thio]-2-nitro-benzoic acid Formula: C11H8N2O4S2 MolecularWeight: 296.32222

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)SC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CC1=CSC(=N1)SC2=CC(=C(C=C2)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C11H8N2O4S2/c1-6-5-18-11(12-6)19-7-2-3-9(13(16)17)8(4-7)10(14)15/h2-5H,1H3,(H,14,15)