(5E)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(furan-2-ylmethylidene)-3-phenyl-imidazol-4-one

Systemtic Name: (5E)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethyl]sulfanyl-5-(furan-2-ylmethylidene)-3-phenyl-imidazol-4-one Openeye Name: (5E)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethyl]sulfanyl-5-(2-furylmethylene)-3-phenyl-imidazol-4-one CAS Name: (5E)-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]thio]-5-(2-furanylmethylidene)-3-phenyl-4-imidazolone IUPAC Name: (5E)-2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]sulfanyl-5-(furan-2-ylmethylidene)-3-phenylimidazol-4-one Traditional Name: (5E)-2-[[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethyl]thio]-5-(2-furfurylidene)-3-phenyl-2-imidazolin-4-one Formula: C25H21N3O3S MolecularWeight: 443.51754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC(=CC4=CC=CO4)C(=O)N3C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CSC3=N/C(=C/C4=CC=CO4)/C(=O)N3C5=CC=CC=C5

InChI

InChI=1S/C25H21N3O3S/c29-23(27-13-12-18-7-4-5-8-19(18)16-27)17-32-25-26-22(15-21-11-6-14-31-21)24(30)28(25)20-9-2-1-3-10-20/h1-11,14-15H,12-13,16-17H2/b22-15+