[6-[ethyl(methyl)carbamothioyl]oxy-2,3-dihydro-1H-inden-1-yl]-prop-2-ynyl-azanium chloride

Systemtic Name: [6-[ethyl(methyl)carbamothioyl]oxy-2,3-dihydro-1H-inden-1-yl]-prop-2-ynyl-azanium chloride Openeye Name: [6-[ethyl(methyl)carbamothioyl]oxyindan-1-yl]-prop-2-ynyl-ammonium chloride CAS Name: [6-[[ethyl(methyl)amino]-sulfanylidenemethoxy]-2,3-dihydro-1H-inden-1-yl]-prop-2-ynylammonium chloride IUPAC Name: [6-[ethyl(methyl)carbamothioyl]oxy-2,3-dihydro-1H-inden-1-yl]-prop-2-ynylazanium chloride Traditional Name: [6-[ethyl(methyl)thiocarbamoyl]oxyindan-1-yl]-propargyl-ammonium chloride Formula: C16H21ClN2OS MolecularWeight: 324.86874

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(C)C(=S)OC1=CC2=C(CCC2[NH2+]CC#C)C=C1.[Cl-]

Isomeric SMILES

CCN(C)C(=S)OC1=CC2=C(CCC2[NH2+]CC#C)C=C1.[Cl-]

InChI

InChI=1S/C16H20N2OS.ClH/c1-4-10-17-15-9-7-12-6-8-13(11-14(12)15)19-16(20)18(3)5-2;/h1,6,8,11,15,17H,5,7,9-10H2,2-3H3;1H