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

Systemtic Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Openeye Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-phenyl-2-thioxo-1H-imidazol-4-yl)methanone CAS Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone IUPAC Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-phenyl-2-sulfanylidene-1H-imidazol-4-yl)methanone Traditional Name: (6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-(3-phenyl-2-thioxo-4-imidazolin-4-yl)methanone Formula: C21H21N3O3S MolecularWeight: 395.47474

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CNC(=S)N3C4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)C3=CNC(=S)N3C4=CC=CC=C4)OC

InChI

InChI=1S/C21H21N3O3S/c1-26-18-10-14-8-9-23(13-15(14)11-19(18)27-2)20(25)17-12-22-21(28)24(17)16-6-4-3-5-7-16/h3-7,10-12H,8-9,13H2,1-2H3,(H,22,28)