3-methylsulfanyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propan-1-amine

Systemtic Name: 3-methylsulfanyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propan-1-amine Openeye Name: 3-methylsulfanyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propan-1-amine CAS Name: 3-(methylthio)-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]-1-propanamine IUPAC Name: 3-methylsulfanyl-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propan-1-amine Traditional Name: [3-(methylthio)-1-[5-(trifluoromethyl)-1,3-benzothiazol-2-yl]propyl]amine Formula: C12H13F3N2S2 MolecularWeight: 306.37023

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13F3N2S2/c1-18-5-4-8(16)11-17-9-6-7(12(13,14)15)2-3-10(9)19-11/h2-3,6,8H,4-5,16H2,1H3