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

Systemtic Name: 2-[2-[2-(3-methyl-4-oxidanylidene-phthalazin-1-yl)carbonylhydrazinyl]-2-oxidanylidene-ethyl]sulfanyl-N-(4-methylphenyl)ethanamide Openeye Name: 2-[2-[2-(3-methyl-4-oxo-phthalazine-1-carbonyl)hydrazino]-2-oxo-ethyl]sulfanyl-N-(p-tolyl)acetamide CAS Name: 2-[[2-[[(3-methyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-2-oxoethyl]thio]-N-(4-methylphenyl)acetamide IUPAC Name: 2-[2-[2-(3-methyl-4-oxophthalazine-1-carbonyl)hydrazinyl]-2-oxoethyl]sulfanyl-N-(4-methylphenyl)acetamide Traditional Name: 2-[[2-keto-2-[N'-(4-keto-3-methyl-phthalazine-1-carbonyl)hydrazino]ethyl]thio]-N-(p-tolyl)acetamide Formula: C21H21N5O4S MolecularWeight: 439.48754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)CSCC(=O)NNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C

InChI

InChI=1S/C21H21N5O4S/c1-13-7-9-14(10-8-13)22-17(27)11-31-12-18(28)23-24-20(29)19-15-5-3-4-6-16(15)21(30)26(2)25-19/h3-10H,11-12H2,1-2H3,(H,22,27)(H,23,28)(H,24,29)