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

Systemtic Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(furan-2-ylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanone Openeye Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(2-furylmethyl)-5-phenyl-imidazol-2-yl]sulfanyl-ethanone CAS Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[1-(2-furanylmethyl)-5-phenyl-2-imidazolyl]thio]ethanone IUPAC Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[1-(furan-2-ylmethyl)-5-phenylimidazol-2-yl]sulfanylethanone Traditional Name: 1-(3,4-dihydro-1H-isoquinolin-2-yl)-2-[[1-(2-furfuryl)-5-phenyl-imidazol-2-yl]thio]ethanone Formula: C25H23N3O2S MolecularWeight: 429.53402

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC=C(N3CC4=CC=CO4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C(=O)CSC3=NC=C(N3CC4=CC=CO4)C5=CC=CC=C5

InChI

InChI=1S/C25H23N3O2S/c29-24(27-13-12-19-7-4-5-10-21(19)16-27)18-31-25-26-15-23(20-8-2-1-3-9-20)28(25)17-22-11-6-14-30-22/h1-11,14-15H,12-13,16-18H2