N-ethoxy-2-methyl-1-prop-2-ynyl-quinolin-1-ium-6-carbothioamide

Systemtic Name: N-ethoxy-2-methyl-1-prop-2-ynyl-quinolin-1-ium-6-carbothioamide Openeye Name: N-ethoxy-2-methyl-1-prop-2-ynyl-quinolin-1-ium-6-carbothioamide CAS Name: N-ethoxy-2-methyl-1-prop-2-ynyl-6-quinolin-1-iumcarbothioamide IUPAC Name: N-ethoxy-2-methyl-1-prop-2-ynylquinolin-1-ium-6-carbothioamide Traditional Name: N-ethoxy-2-methyl-1-propargyl-quinolin-1-ium-6-carbothioamide Formula: C16H17N2OS+ MolecularWeight: 285.38398

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCONC(=S)C1=CC2=C(C=C1)[N+](=C(C=C2)C)CC#C

Isomeric SMILES

CCONC(=S)C1=CC2=C(C=C1)[N+](=C(C=C2)C)CC#C

InChI

InChI=1S/C16H16N2OS/c1-4-10-18-12(3)6-7-13-11-14(8-9-15(13)18)16(20)17-19-5-2/h1,6-9,11H,5,10H2,2-3H3/p+1