N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[2-[(4-chlorophenyl)methylthio]ethyl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-[2-[(4-chlorophenyl)methylsulfanyl]ethyl]-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[2-[(4-chlorobenzyl)thio]ethyl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C20H20ClN3O2S MolecularWeight: 401.9097

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NCCSCC3=CC=C(C=C3)Cl

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NCCSCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H20ClN3O2S/c1-24-20(26)17-5-3-2-4-16(17)18(23-24)12-19(25)22-10-11-27-13-14-6-8-15(21)9-7-14/h2-9H,10-13H2,1H3,(H,22,25)