2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-4-phenyl-phthalazin-1-one

Systemtic Name: 2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-4-phenyl-phthalazin-1-one Openeye Name: 2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-4-phenyl-phthalazin-1-one CAS Name: 2-[[methyl-[[4-(methylthio)phenyl]methyl]amino]methyl]-4-phenyl-1-phthalazinone IUPAC Name: 2-[[methyl-[(4-methylsulfanylphenyl)methyl]amino]methyl]-4-phenylphthalazin-1-one Traditional Name: 2-[[methyl-[4-(methylthio)benzyl]amino]methyl]-4-phenyl-phthalazin-1-one Formula: C24H23N3OS MolecularWeight: 401.52392

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)SC)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CC=C4

Isomeric SMILES

CN(CC1=CC=C(C=C1)SC)CN2C(=O)C3=CC=CC=C3C(=N2)C4=CC=CC=C4

InChI

InChI=1S/C24H23N3OS/c1-26(16-18-12-14-20(29-2)15-13-18)17-27-24(28)22-11-7-6-10-21(22)23(25-27)19-8-4-3-5-9-19/h3-15H,16-17H2,1-2H3