N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide

Systemtic Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(1-oxidanylidenephthalazin-2-yl)ethanamide Openeye Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(1-oxophthalazin-2-yl)acetamide CAS Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-(1-oxo-2-phthalazinyl)acetamide IUPAC Name: N-[2-(4-chlorophenyl)sulfanylphenyl]-2-(1-oxophthalazin-2-yl)acetamide Traditional Name: N-[2-[(4-chlorophenyl)thio]phenyl]-2-(1-ketophthalazin-2-yl)acetamide Formula: C22H16ClN3O2S MolecularWeight: 421.89934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C=NN(C2=O)CC(=O)NC3=CC=CC=C3SC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H16ClN3O2S/c23-16-9-11-17(12-10-16)29-20-8-4-3-7-19(20)25-21(27)14-26-22(28)18-6-2-1-5-15(18)13-24-26/h1-13H,14H2,(H,25,27)