2-(4-phenylphthalazin-1-yl)sulfanyl-1-(4-propylphenyl)ethanone

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCCC1=CC=C(C=C1)C(=O)CSC2=NN=C(C3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2OS/c1-2-8-18-13-15-19(16-14-18)23(28)17-29-25-22-12-7-6-11-21(22)24(26-27-25)20-9-4-3-5-10-20/h3-7,9-16H,2,8,17H2,1H3