1-(1,3-benzothiazol-2-yl)-2-(3-bromanyl-4-fluoranyl-phenyl)-N-methyl-ethanamine

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-2-(3-bromanyl-4-fluoranyl-phenyl)-N-methyl-ethanamine Openeye Name: 1-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-fluoro-phenyl)-N-methyl-ethanamine CAS Name: 1-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-fluorophenyl)-N-methylethanamine IUPAC Name: 1-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-fluorophenyl)-N-methylethanamine Traditional Name: [1-(1,3-benzothiazol-2-yl)-2-(3-bromo-4-fluoro-phenyl)ethyl]-methyl-amine Formula: C16H14BrFN2S MolecularWeight: 365.263163

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Descriptors Computed from Structure

Canonical SMILES:

CNC(CC1=CC(=C(C=C1)F)Br)C2=NC3=CC=CC=C3S2

Isomeric SMILES

CNC(CC1=CC(=C(C=C1)F)Br)C2=NC3=CC=CC=C3S2

InChI

InChI=1S/C16H14BrFN2S/c1-19-14(9-10-6-7-12(18)11(17)8-10)16-20-13-4-2-3-5-15(13)21-16/h2-8,14,19H,9H2,1H3