1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-5-phenyl-imidazol-2-yl)sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-methyl-5-phenyl-2-imidazolyl)thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-(1-methyl-5-phenylimidazol-2-yl)sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[(1-methyl-5-phenyl-imidazol-2-yl)thio]ethanone Formula: C21H21N3OS MolecularWeight: 363.47594

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=CN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4

Isomeric SMILES

CN1C(=CN=C1SCC(=O)N2CCC3=CC=CC=C3C2)C4=CC=CC=C4

InChI

InChI=1S/C21H21N3OS/c1-23-19(17-8-3-2-4-9-17)13-22-21(23)26-15-20(25)24-12-11-16-7-5-6-10-18(16)14-24/h2-10,13H,11-12,14-15H2,1H3