1-(4-bromanyl-2-fluoranyl-phenyl)-N-methyl-N-(thiolan-3-yl)ethane-1,2-diamine

Systemtic Name: 1-(4-bromanyl-2-fluoranyl-phenyl)-N-methyl-N-(thiolan-3-yl)ethane-1,2-diamine Openeye Name: 1-(4-bromo-2-fluoro-phenyl)-N-methyl-N-tetrahydrothiophen-3-yl-ethane-1,2-diamine CAS Name: 1-(4-bromo-2-fluorophenyl)-N-methyl-N-(3-thiolanyl)ethane-1,2-diamine IUPAC Name: 1-(4-bromo-2-fluorophenyl)-N-methyl-N-(thiolan-3-yl)ethane-1,2-diamine Traditional Name: [2-amino-1-(4-bromo-2-fluoro-phenyl)ethyl]-methyl-tetrahydrothiophen-3-yl-amine Formula: C13H18BrFN2S MolecularWeight: 333.262823

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Descriptors Computed from Structure

Canonical SMILES:

CN(C1CCSC1)C(CN)C2=C(C=C(C=C2)Br)F

Isomeric SMILES

CN(C1CCSC1)C(CN)C2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C13H18BrFN2S/c1-17(10-4-5-18-8-10)13(7-16)11-3-2-9(14)6-12(11)15/h2-3,6,10,13H,4-5,7-8,16H2,1H3