5-(diphenylmethyl)sulfanylquinazolino[2,3-a]phthalazin-8-one

Systemtic Name: 5-(diphenylmethyl)sulfanylquinazolino[2,3-a]phthalazin-8-one Openeye Name: 5-benzhydrylsulfanylquinazolino[2,3-a]phthalazin-8-one CAS Name: 5-[(diphenylmethyl)thio]-8-quinazolino[2,3-a]phthalazinone IUPAC Name: 5-benzhydrylsulfanylquinazolino[2,3-a]phthalazin-8-one Traditional Name: 5-(benzhydrylthio)quinazolino[2,3-a]phthalazin-8-one Formula: C28H19N3OS MolecularWeight: 445.53496

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=NN4C(=NC5=CC=CC=C5C4=O)C6=CC=CC=C63

Isomeric SMILES

C1=CC=C(C=C1)C(C2=CC=CC=C2)SC3=NN4C(=NC5=CC=CC=C5C4=O)C6=CC=CC=C63

InChI

InChI=1S/C28H19N3OS/c32-28-23-17-9-10-18-24(23)29-26-21-15-7-8-16-22(21)27(30-31(26)28)33-25(19-11-3-1-4-12-19)20-13-5-2-6-14-20/h1-18,25H