3-(4-methylsulfanylphenyl)-6-oxidanyl-5-(phenylmethyl)imidazo[5,1-a]phthalazin-1-one

Systemtic Name: 3-(4-methylsulfanylphenyl)-6-oxidanyl-5-(phenylmethyl)imidazo[5,1-a]phthalazin-1-one Openeye Name: 5-benzyl-6-hydroxy-3-(4-methylsulfanylphenyl)imidazo[5,1-a]phthalazin-1-one CAS Name: 6-hydroxy-3-[4-(methylthio)phenyl]-5-(phenylmethyl)-1-imidazo[5,1-a]phthalazinone IUPAC Name: 5-benzyl-6-hydroxy-3-(4-methylsulfanylphenyl)imidazo[5,1-a]phthalazin-1-one Traditional Name: 5-benzyl-6-hydroxy-3-[4-(methylthio)phenyl]imidazo[5,1-a]phthalazin-1-one Formula: C24H19N3O2S MolecularWeight: 413.49156

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=NC(=O)C3=C4C=CC=CC4=C(N(N32)CC5=CC=CC=C5)O

Isomeric SMILES

CSC1=CC=C(C=C1)C2=NC(=O)C3=C4C=CC=CC4=C(N(N32)CC5=CC=CC=C5)O

InChI

InChI=1S/C24H19N3O2S/c1-30-18-13-11-17(12-14-18)22-25-23(28)21-19-9-5-6-10-20(19)24(29)26(27(21)22)15-16-7-3-2-4-8-16/h2-14,29H,15H2,1H3