7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]-1,3-benzothiazole-5-carboxylic acid

Systemtic Name: 7-fluoranyl-6-[(4-iodanyl-2-methyl-phenyl)amino]-1,3-benzothiazole-5-carboxylic acid Openeye Name: 7-fluoro-6-(4-iodo-2-methyl-anilino)-1,3-benzothiazole-5-carboxylic acid CAS Name: 7-fluoro-6-(4-iodo-2-methylanilino)-1,3-benzothiazole-5-carboxylic acid IUPAC Name: 7-fluoro-6-(4-iodo-2-methylanilino)-1,3-benzothiazole-5-carboxylic acid Traditional Name: 7-fluoro-6-(4-iodo-2-methyl-anilino)-1,3-benzothiazole-5-carboxylic acid Formula: C15H10FIN2O2S MolecularWeight: 428.219973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)N=CS3)F

Isomeric SMILES

CC1=C(C=CC(=C1)I)NC2=C(C3=C(C=C2C(=O)O)N=CS3)F

InChI

InChI=1S/C15H10FIN2O2S/c1-7-4-8(17)2-3-10(7)19-13-9(15(20)21)5-11-14(12(13)16)22-6-18-11/h2-6,19H,1H3,(H,20,21)