N-(2-cyclopentylsulfanylphenyl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide

Systemtic Name: N-(2-cyclopentylsulfanylphenyl)-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)ethanamide Openeye Name: N-(2-cyclopentylsulfanylphenyl)-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: N-[2-(cyclopentylthio)phenyl]-2-(3-methyl-4-oxo-1-phthalazinyl)acetamide IUPAC Name: N-(2-cyclopentylsulfanylphenyl)-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[2-(cyclopentylthio)phenyl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C22H23N3O2S MolecularWeight: 393.50192

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NC3=CC=CC=C3SC4CCCC4

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)NC3=CC=CC=C3SC4CCCC4

InChI

InChI=1S/C22H23N3O2S/c1-25-22(27)17-11-5-4-10-16(17)19(24-25)14-21(26)23-18-12-6-7-13-20(18)28-15-8-2-3-9-15/h4-7,10-13,15H,2-3,8-9,14H2,1H3,(H,23,26)