N,N-dimethyl-3-[3-[4-(trifluoromethyl)phenyl]-1,2-benzothiazol-6-yl]prop-2-yn-1-amine

Systemtic Name: N,N-dimethyl-3-[3-[4-(trifluoromethyl)phenyl]-1,2-benzothiazol-6-yl]prop-2-yn-1-amine Openeye Name: N,N-dimethyl-3-[3-[4-(trifluoromethyl)phenyl]-1,2-benzothiazol-6-yl]prop-2-yn-1-amine CAS Name: N,N-dimethyl-3-[3-[4-(trifluoromethyl)phenyl]-1,2-benzothiazol-6-yl]-2-propyn-1-amine IUPAC Name: N,N-dimethyl-3-[3-[4-(trifluoromethyl)phenyl]-1,2-benzothiazol-6-yl]prop-2-yn-1-amine Traditional Name: dimethyl-[3-[3-[4-(trifluoromethyl)phenyl]-1,2-benzothiazol-6-yl]prop-2-ynyl]amine Formula: C19H15F3N2S MolecularWeight: 360.39601

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CC#CC1=CC2=C(C=C1)C(=NS2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

CN(C)CC#CC1=CC2=C(C=C1)C(=NS2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C19H15F3N2S/c1-24(2)11-3-4-13-5-10-16-17(12-13)25-23-18(16)14-6-8-15(9-7-14)19(20,21)22/h5-10,12H,11H2,1-2H3