N-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide

Systemtic Name: N-[[2-bromanyl-4,6-bis(fluoranyl)phenyl]carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Openeye Name: N-[(2-bromo-4,6-difluoro-phenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide CAS Name: N-[(2-bromo-4,6-difluoroanilino)-sulfanylidenemethyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide IUPAC Name: N-[(2-bromo-4,6-difluorophenyl)carbamothioyl]-2,3-dihydro-1,4-benzodioxine-6-carboxamide Traditional Name: N-[(2-bromo-4,6-difluoro-phenyl)thiocarbamoyl]-2,3-dihydro-1,4-benzodioxin-6-carboxamide Formula: C16H11BrF2N2O3S MolecularWeight: 429.235946

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(O1)C=CC(=C2)C(=O)NC(=S)NC3=C(C=C(C=C3Br)F)F

Isomeric SMILES

C1COC2=C(O1)C=CC(=C2)C(=O)NC(=S)NC3=C(C=C(C=C3Br)F)F

InChI

InChI=1S/C16H11BrF2N2O3S/c17-10-6-9(18)7-11(19)14(10)20-16(25)21-15(22)8-1-2-12-13(5-8)24-4-3-23-12/h1-2,5-7H,3-4H2,(H2,20,21,22,25)