1-(5-fluoranyl-1,3-benzothiazol-2-yl)-3-methyl-butan-1-amine

Systemtic Name: 1-(5-fluoranyl-1,3-benzothiazol-2-yl)-3-methyl-butan-1-amine Openeye Name: 1-(5-fluoro-1,3-benzothiazol-2-yl)-3-methyl-butan-1-amine CAS Name: 1-(5-fluoro-1,3-benzothiazol-2-yl)-3-methyl-1-butanamine IUPAC Name: 1-(5-fluoro-1,3-benzothiazol-2-yl)-3-methylbutan-1-amine Traditional Name: [1-(5-fluoro-1,3-benzothiazol-2-yl)-3-methyl-butyl]amine Formula: C12H15FN2S MolecularWeight: 238.324303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C1=NC2=C(S1)C=CC(=C2)F)N

Isomeric SMILES

CC(C)CC(C1=NC2=C(S1)C=CC(=C2)F)N

InChI

InChI=1S/C12H15FN2S/c1-7(2)5-9(14)12-15-10-6-8(13)3-4-11(10)16-12/h3-4,6-7,9H,5,14H2,1-2H3