1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-methyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-methylimidazol-2-yl)thio]ethanone Formula: C15H17N3OS MolecularWeight: 287.37998

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1SCC(=O)N2CCC3=CC=CC=C3C2

Isomeric SMILES

CN1C=CN=C1SCC(=O)N2CCC3=CC=CC=C3C2

InChI

InChI=1S/C15H17N3OS/c1-17-9-7-16-15(17)20-11-14(19)18-8-6-12-4-2-3-5-13(12)10-18/h2-5,7,9H,6,8,10-11H2,1H3