2-(5-bromanyl-2-methoxy-phenyl)-6-(trifluoromethyl)-4H-1,4-benzothiazine-3-thione

Systemtic Name: 2-(5-bromanyl-2-methoxy-phenyl)-6-(trifluoromethyl)-4H-1,4-benzothiazine-3-thione Openeye Name: 2-(5-bromo-2-methoxy-phenyl)-6-(trifluoromethyl)-4H-1,4-benzothiazine-3-thione CAS Name: 2-(5-bromo-2-methoxyphenyl)-6-(trifluoromethyl)-4H-1,4-benzothiazine-3-thione IUPAC Name: 2-(5-bromo-2-methoxyphenyl)-6-(trifluoromethyl)-4H-1,4-benzothiazine-3-thione Traditional Name: 2-(5-bromo-2-methoxy-phenyl)-6-(trifluoromethyl)-4H-1,4-benzothiazine-3-thione Formula: C16H11BrF3NOS2 MolecularWeight: 434.29385

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C2C(=S)NC3=C(S2)C=CC(=C3)C(F)(F)F

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C2C(=S)NC3=C(S2)C=CC(=C3)C(F)(F)F

InChI

InChI=1S/C16H11BrF3NOS2/c1-22-12-4-3-9(17)7-10(12)14-15(23)21-11-6-8(16(18,19)20)2-5-13(11)24-14/h2-7,14H,1H3,(H,21,23)