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

Systemtic Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: 2-(4-oxo-3H-phthalazin-1-yl)-N-[2-(p-tolylmethylsulfanyl)ethyl]acetamide CAS Name: N-[2-[(4-methylphenyl)methylthio]ethyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[2-[(4-methylphenyl)methylsulfanyl]ethyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: 2-(4-keto-3H-phthalazin-1-yl)-N-[2-[(4-methylbenzyl)thio]ethyl]acetamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCCNC(=O)CC2=NNC(=O)C3=CC=CC=C32

Isomeric SMILES

CC1=CC=C(C=C1)CSCCNC(=O)CC2=NNC(=O)C3=CC=CC=C32

InChI

InChI=1S/C20H21N3O2S/c1-14-6-8-15(9-7-14)13-26-11-10-21-19(24)12-18-16-4-2-3-5-17(16)20(25)23-22-18/h2-9H,10-13H2,1H3,(H,21,24)(H,23,25)