N-(2-cyanophenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(2-cyanophenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(2-cyanophenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(2-cyanophenyl)-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(2-cyanophenyl)-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(2-cyanophenyl)-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C23H16N4OS MolecularWeight: 396.46434

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC=C4C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=CC=CC=C4C#N

InChI

InChI=1S/C23H16N4OS/c24-14-17-10-4-7-13-20(17)25-21(28)15-29-23-19-12-6-5-11-18(19)22(26-27-23)16-8-2-1-3-9-16/h1-13H,15H2,(H,25,28)