2-(4-phenylphthalazin-1-yl)sulfanyl-1-(2,4,5-trimethylphenyl)ethanone

Systemtic Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-1-(2,4,5-trimethylphenyl)ethanone Openeye Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-1-(2,4,5-trimethylphenyl)ethanone CAS Name: 2-[(4-phenyl-1-phthalazinyl)thio]-1-(2,4,5-trimethylphenyl)ethanone IUPAC Name: 2-(4-phenylphthalazin-1-yl)sulfanyl-1-(2,4,5-trimethylphenyl)ethanone Traditional Name: 2-[(4-phenylphthalazin-1-yl)thio]-1-(2,4,5-trimethylphenyl)ethanone Formula: C25H22N2OS MolecularWeight: 398.51998

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C)C

Isomeric SMILES

CC1=CC(=C(C=C1C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4)C)C

InChI

InChI=1S/C25H22N2OS/c1-16-13-18(3)22(14-17(16)2)23(28)15-29-25-21-12-8-7-11-20(21)24(26-27-25)19-9-5-4-6-10-19/h4-14H,15H2,1-3H3