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

Systemtic Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromanyl-2-fluoranyl-phenyl)ethanamine Openeye Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-fluoro-phenyl)ethanamine CAS Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-fluorophenyl)ethanamine IUPAC Name: 1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-fluorophenyl)ethanamine Traditional Name: [1-(1,3-benzothiazol-2-yl)-2-(4-bromo-2-fluoro-phenyl)ethyl]amine Formula: C15H12BrFN2S MolecularWeight: 351.236583

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N=C(S2)C(CC3=C(C=C(C=C3)Br)F)N

Isomeric SMILES

C1=CC=C2C(=C1)N=C(S2)C(CC3=C(C=C(C=C3)Br)F)N

InChI

InChI=1S/C15H12BrFN2S/c16-10-6-5-9(11(17)8-10)7-12(18)15-19-13-3-1-2-4-14(13)20-15/h1-6,8,12H,7,18H2