6-[(4-chloranyl-2-methyl-phenyl)amino]-7-fluoranyl-3-(1,3-oxazol-5-ylmethyl)benzimidazole-5-carboxylic acid

Systemtic Name: 6-[(4-chloranyl-2-methyl-phenyl)amino]-7-fluoranyl-3-(1,3-oxazol-5-ylmethyl)benzimidazole-5-carboxylic acid Openeye Name: 6-(4-chloro-2-methyl-anilino)-7-fluoro-3-(oxazol-5-ylmethyl)benzimidazole-5-carboxylic acid CAS Name: 6-(4-chloro-2-methylanilino)-7-fluoro-3-(5-oxazolylmethyl)-5-benzimidazolecarboxylic acid IUPAC Name: 6-(4-chloro-2-methylanilino)-7-fluoro-3-(1,3-oxazol-5-ylmethyl)benzimidazole-5-carboxylic acid Traditional Name: 6-(4-chloro-2-methyl-anilino)-7-fluoro-3-(oxazol-5-ylmethyl)benzimidazole-5-carboxylic acid Formula: C19H14ClFN4O3 MolecularWeight: 400.790863

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)Cl)NC2=C(C3=C(C=C2C(=O)O)N(C=N3)CC4=CN=CO4)F

Isomeric SMILES

CC1=C(C=CC(=C1)Cl)NC2=C(C3=C(C=C2C(=O)O)N(C=N3)CC4=CN=CO4)F

InChI

InChI=1S/C19H14ClFN4O3/c1-10-4-11(20)2-3-14(10)24-17-13(19(26)27)5-15-18(16(17)21)23-8-25(15)7-12-6-22-9-28-12/h2-6,8-9,24H,7H2,1H3,(H,26,27)