N-(3-chloranyl-4-cyano-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide

Systemtic Name: N-(3-chloranyl-4-cyano-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-ethanamide Openeye Name: N-(3-chloro-4-cyano-phenyl)-2-(4-phenylphthalazin-1-yl)sulfanyl-acetamide CAS Name: N-(3-chloro-4-cyanophenyl)-2-[(4-phenyl-1-phthalazinyl)thio]acetamide IUPAC Name: N-(3-chloro-4-cyanophenyl)-2-(4-phenylphthalazin-1-yl)sulfanylacetamide Traditional Name: N-(3-chloro-4-cyano-phenyl)-2-[(4-phenylphthalazin-1-yl)thio]acetamide Formula: C23H15ClN4OS MolecularWeight: 430.9094

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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(=C(C=C4)C#N)Cl

Isomeric SMILES

C1=CC=C(C=C1)C2=NN=C(C3=CC=CC=C32)SCC(=O)NC4=CC(=C(C=C4)C#N)Cl

InChI

InChI=1S/C23H15ClN4OS/c24-20-12-17(11-10-16(20)13-25)26-21(29)14-30-23-19-9-5-4-8-18(19)22(27-28-23)15-6-2-1-3-7-15/h1-12H,14H2,(H,26,29)