1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanone

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[1-(2,5-dimethylphenyl)-2-imidazolyl]thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2,5-dimethylphenyl)imidazol-2-yl]sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[1-(2,5-dimethylphenyl)imidazol-2-yl]thio]ethanone Formula: C22H23N3OS MolecularWeight: 377.50252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2C=CN=C2SCC(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2C=CN=C2SCC(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C22H23N3OS/c1-16-7-8-17(2)20(13-16)25-12-10-23-22(25)27-15-21(26)24-11-9-18-5-3-4-6-19(18)14-24/h3-8,10,12-13H,9,11,14-15H2,1-2H3