phenyl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methanamine

Systemtic Name: phenyl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methanamine Openeye Name: phenyl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methanamine CAS Name: phenyl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methanamine IUPAC Name: phenyl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methanamine Traditional Name: [phenyl-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]methyl]amine Formula: C15H11F3N2S MolecularWeight: 308.32145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=NC3=C(S2)C=CC(=C3)C(F)(F)F)N

Isomeric SMILES

C1=CC=C(C=C1)C(C2=NC3=C(S2)C=CC(=C3)C(F)(F)F)N

InChI

InChI=1S/C15H11F3N2S/c16-15(17,18)10-6-7-12-11(8-10)20-14(21-12)13(19)9-4-2-1-3-5-9/h1-8,13H,19H2