6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-3-methyl-N-methylsulfonyl-1,2-benzoxazole-5-carboxamide

Systemtic Name: 6-[(4-bromanyl-2-chloranyl-phenyl)amino]-7-fluoranyl-3-methyl-N-methylsulfonyl-1,2-benzoxazole-5-carboxamide Openeye Name: 6-(4-bromo-2-chloro-anilino)-7-fluoro-3-methyl-N-methylsulfonyl-1,2-benzoxazole-5-carboxamide CAS Name: 6-(4-bromo-2-chloroanilino)-7-fluoro-3-methyl-N-methylsulfonyl-1,2-benzoxazole-5-carboxamide IUPAC Name: 6-(4-bromo-2-chloroanilino)-7-fluoro-3-methyl-N-methylsulfonyl-1,2-benzoxazole-5-carboxamide Traditional Name: 6-(4-bromo-2-chloro-anilino)-7-fluoro-N-mesyl-3-methyl-indoxazene-5-carboxamide Formula: C16H12BrClFN3O4S MolecularWeight: 476.704583

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC2=C(C(=C(C=C12)C(=O)NS(=O)(=O)C)NC3=C(C=C(C=C3)Br)Cl)F

Isomeric SMILES

CC1=NOC2=C(C(=C(C=C12)C(=O)NS(=O)(=O)C)NC3=C(C=C(C=C3)Br)Cl)F

InChI

InChI=1S/C16H12BrClFN3O4S/c1-7-9-6-10(16(23)22-27(2,24)25)14(13(19)15(9)26-21-7)20-12-4-3-8(17)5-11(12)18/h3-6,20H,1-2H3,(H,22,23)