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

Systemtic Name: N-methyl-2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)-N-[2-[(2-methylsulfanylphenyl)amino]-2-oxidanylidene-ethyl]ethanamide Openeye Name: N-methyl-2-(3-methyl-4-oxo-phthalazin-1-yl)-N-[2-(2-methylsulfanylanilino)-2-oxo-ethyl]acetamide CAS Name: N-methyl-2-(3-methyl-4-oxo-1-phthalazinyl)-N-[2-[2-(methylthio)anilino]-2-oxoethyl]acetamide IUPAC Name: N-methyl-2-(3-methyl-4-oxophthalazin-1-yl)-N-[2-(2-methylsulfanylanilino)-2-oxoethyl]acetamide Traditional Name: 2-(4-keto-3-methyl-phthalazin-1-yl)-N-[2-keto-2-[2-(methylthio)anilino]ethyl]-N-methyl-acetamide Formula: C21H22N4O3S MolecularWeight: 410.48938

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N(C)CC(=O)NC3=CC=CC=C3SC

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2C(=N1)CC(=O)N(C)CC(=O)NC3=CC=CC=C3SC

InChI

InChI=1S/C21H22N4O3S/c1-24(13-19(26)22-16-10-6-7-11-18(16)29-3)20(27)12-17-14-8-4-5-9-15(14)21(28)25(2)23-17/h4-11H,12-13H2,1-3H3,(H,22,26)