N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[4-(2,5-dimethylphenyl)sulfanylphenyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[4-[(2,5-dimethylphenyl)thio]phenyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C24H21N3O2S MolecularWeight: 415.50744

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

Isomeric SMILES

CC1=CC(=C(C=C1)C)SC2=CC=C(C=C2)NC(=O)CC3=NNC(=O)C4=CC=CC=C43

InChI

InChI=1S/C24H21N3O2S/c1-15-7-8-16(2)22(13-15)30-18-11-9-17(10-12-18)25-23(28)14-21-19-5-3-4-6-20(19)24(29)27-26-21/h3-13H,14H2,1-2H3,(H,25,28)(H,27,29)