N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine

Systemtic Name: N-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[(4-bromo-2-fluoro-phenyl)methyl]-1,1-dioxo-thian-4-amine CAS Name: N-[(4-bromo-2-fluorophenyl)methyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[(4-bromo-2-fluorophenyl)methyl]-1,1-dioxothian-4-amine Traditional Name: (4-bromo-2-fluoro-benzyl)-(1,1-diketothian-4-yl)amine Formula: C12H15BrFNO2S MolecularWeight: 336.220403

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NCC2=C(C=C(C=C2)Br)F

Isomeric SMILES

C1CS(=O)(=O)CCC1NCC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C12H15BrFNO2S/c13-10-2-1-9(12(14)7-10)8-15-11-3-5-18(16,17)6-4-11/h1-2,7,11,15H,3-6,8H2