2-[[3-aminocarbonyl-2,4-bis(fluoranyl)phenoxy]methyl]-1,3-benzothiazole-5-carboxylic acid

Systemtic Name: 2-[[3-aminocarbonyl-2,4-bis(fluoranyl)phenoxy]methyl]-1,3-benzothiazole-5-carboxylic acid Openeye Name: 2-[(3-carbamoyl-2,4-difluoro-phenoxy)methyl]-1,3-benzothiazole-5-carboxylic acid CAS Name: 2-[(3-carbamoyl-2,4-difluorophenoxy)methyl]-1,3-benzothiazole-5-carboxylic acid IUPAC Name: 2-[(3-carbamoyl-2,4-difluorophenoxy)methyl]-1,3-benzothiazole-5-carboxylic acid Traditional Name: 2-[(3-carbamoyl-2,4-difluoro-phenoxy)methyl]-1,3-benzothiazole-5-carboxylic acid Formula: C16H10F2N2O4S MolecularWeight: 364.323406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1C(=O)O)N=C(S2)COC3=C(C(=C(C=C3)F)C(=O)N)F

Isomeric SMILES

C1=CC2=C(C=C1C(=O)O)N=C(S2)COC3=C(C(=C(C=C3)F)C(=O)N)F

InChI

InChI=1S/C16H10F2N2O4S/c17-8-2-3-10(14(18)13(8)15(19)21)24-6-12-20-9-5-7(16(22)23)1-4-11(9)25-12/h1-5H,6H2,(H2,19,21)(H,22,23)