N-but-2-ynyl-6-(trifluoromethyloxy)-1,3-benzothiazol-2-amine hydrochloride

Systemtic Name: N-but-2-ynyl-6-(trifluoromethyloxy)-1,3-benzothiazol-2-amine hydrochloride Openeye Name: N-but-2-ynyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine hydrochloride CAS Name: N-but-2-ynyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine hydrochloride IUPAC Name: N-but-2-ynyl-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine hydrochloride Traditional Name: but-2-ynyl-[6-(trifluoromethoxy)-1,3-benzothiazol-2-yl]amine hydrochloride Formula: C12H10ClF3N2OS MolecularWeight: 322.73381

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCNC1=NC2=C(S1)C=C(C=C2)OC(F)(F)F.Cl

Isomeric SMILES

CC#CCNC1=NC2=C(S1)C=C(C=C2)OC(F)(F)F.Cl

InChI

InChI=1S/C12H9F3N2OS.ClH/c1-2-3-6-16-11-17-9-5-4-8(7-10(9)19-11)18-12(13,14)15;/h4-5,7H,6H2,1H3,(H,16,17);1H