2-(4-bromanyl-2-fluoranyl-phenyl)-3-sulfanyl-4,5,6,7-tetrahydro-3H-isoindol-1-one

Systemtic Name: 2-(4-bromanyl-2-fluoranyl-phenyl)-3-sulfanyl-4,5,6,7-tetrahydro-3H-isoindol-1-one Openeye Name: 2-(4-bromo-2-fluoro-phenyl)-3-sulfanyl-4,5,6,7-tetrahydro-3H-isoindol-1-one CAS Name: 2-(4-bromo-2-fluorophenyl)-3-mercapto-4,5,6,7-tetrahydro-3H-isoindol-1-one IUPAC Name: 2-(4-bromo-2-fluorophenyl)-3-sulfanyl-4,5,6,7-tetrahydro-3H-isoindol-1-one Traditional Name: 2-(4-bromo-2-fluoro-phenyl)-3-mercapto-4,5,6,7-tetrahydro-3H-isoindol-1-one Formula: C14H13BrFNOS MolecularWeight: 342.226523

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C(N(C2=O)C3=C(C=C(C=C3)Br)F)S

Isomeric SMILES

C1CCC2=C(C1)C(N(C2=O)C3=C(C=C(C=C3)Br)F)S

InChI

InChI=1S/C14H13BrFNOS/c15-8-5-6-12(11(16)7-8)17-13(18)9-3-1-2-4-10(9)14(17)19/h5-7,14,19H,1-4H2