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

Systemtic Name: 2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-[2-(phenylmethylsulfanyl)ethyl]ethanamide Openeye Name: N-(2-benzylsulfanylethyl)-2-(3-methyl-4-oxo-phthalazin-1-yl)acetamide CAS Name: 2-(3-methyl-4-oxo-1-phthalazinyl)-N-[2-(phenylmethylthio)ethyl]acetamide IUPAC Name: N-(2-benzylsulfanylethyl)-2-(3-methyl-4-oxophthalazin-1-yl)acetamide Traditional Name: N-[2-(benzylthio)ethyl]-2-(4-keto-3-methyl-phthalazin-1-yl)acetamide Formula: C20H21N3O2S MolecularWeight: 367.46464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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