1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-propyl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)ethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(3-propyl-5-thioxo-1H-1,2,4-triazol-4-yl)ethanone Formula: C16H20N4OS MolecularWeight: 316.4212

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NNC(=S)N1CC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CCCC1=NNC(=S)N1CC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C16H20N4OS/c1-2-5-14-17-18-16(22)20(14)11-15(21)19-9-8-12-6-3-4-7-13(12)10-19/h3-4,6-7H,2,5,8-11H2,1H3,(H,18,22)