N-[1-(3-bromanyl-4-fluoranyl-phenyl)ethyl]-1,1-bis(oxidanylidene)thian-4-amine

Systemtic Name: N-[1-(3-bromanyl-4-fluoranyl-phenyl)ethyl]-1,1-bis(oxidanylidene)thian-4-amine Openeye Name: N-[1-(3-bromo-4-fluoro-phenyl)ethyl]-1,1-dioxo-thian-4-amine CAS Name: N-[1-(3-bromo-4-fluorophenyl)ethyl]-1,1-dioxo-4-thianamine IUPAC Name: N-[1-(3-bromo-4-fluorophenyl)ethyl]-1,1-dioxothian-4-amine Traditional Name: 1-(3-bromo-4-fluoro-phenyl)ethyl-(1,1-diketothian-4-yl)amine Formula: C13H17BrFNO2S MolecularWeight: 350.246983

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(=C(C=C1)F)Br)NC2CCS(=O)(=O)CC2

Isomeric SMILES

CC(C1=CC(=C(C=C1)F)Br)NC2CCS(=O)(=O)CC2

InChI

InChI=1S/C13H17BrFNO2S/c1-9(10-2-3-13(15)12(14)8-10)16-11-4-6-19(17,18)7-5-11/h2-3,8-9,11,16H,4-7H2,1H3