3,4-dihydro-1H-isoquinolin-2-yl-[4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone

Systemtic Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone Openeye Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[[6-(p-tolyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone CAS Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[[[6-(4-methylphenyl)-3-pyridazinyl]thio]methyl]phenyl]methanone IUPAC Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[[6-(4-methylphenyl)pyridazin-3-yl]sulfanylmethyl]phenyl]methanone Traditional Name: 3,4-dihydro-1H-isoquinolin-2-yl-[4-[[[6-(p-tolyl)pyridazin-3-yl]thio]methyl]phenyl]methanone Formula: C28H25N3OS MolecularWeight: 451.5826

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CC1=CC=C(C=C1)C2=NN=C(C=C2)SCC3=CC=C(C=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C28H25N3OS/c1-20-6-10-23(11-7-20)26-14-15-27(30-29-26)33-19-21-8-12-24(13-9-21)28(32)31-17-16-22-4-2-3-5-25(22)18-31/h2-15H,16-19H2,1H3