(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)methanone

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methylsulfanyl-3-phenyl-imidazol-4-yl)methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(methylthio)-3-phenyl-4-imidazolyl]methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(2-methylsulfanyl-3-phenylimidazol-4-yl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-[2-(methylthio)-3-phenyl-imidazol-4-yl]methanone Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CN=C(N3C4=CC=CC=C4)SC)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CN=C(N3C4=CC=CC=C4)SC)OC

InChI

InChI=1S/C22H23N3O3S/c1-27-19-11-15-9-10-24(14-16(15)12-20(19)28-2)21(26)18-13-23-22(29-3)25(18)17-7-5-4-6-8-17/h4-8,11-13H,9-10,14H2,1-3H3