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

Systemtic Name: N-(3-methylphenyl)-2-[2-oxidanylidene-2-[2-[(4-oxidanylidene-3H-phthalazin-1-yl)carbonyl]hydrazinyl]ethyl]sulfanyl-ethanamide Openeye Name: N-(m-tolyl)-2-[2-oxo-2-[2-(4-oxo-3H-phthalazine-1-carbonyl)hydrazino]ethyl]sulfanyl-acetamide CAS Name: N-(3-methylphenyl)-2-[[2-oxo-2-[[oxo-(4-oxo-3H-phthalazin-1-yl)methyl]hydrazo]ethyl]thio]acetamide IUPAC Name: N-(3-methylphenyl)-2-[2-oxo-2-[2-(4-oxo-3H-phthalazine-1-carbonyl)hydrazinyl]ethyl]sulfanylacetamide Traditional Name: 2-[[2-keto-2-[N'-(4-keto-3H-phthalazine-1-carbonyl)hydrazino]ethyl]thio]-N-(m-tolyl)acetamide Formula: C20H19N5O4S MolecularWeight: 425.46096

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H19N5O4S/c1-12-5-4-6-13(9-12)21-16(26)10-30-11-17(27)22-25-20(29)18-14-7-2-3-8-15(14)19(28)24-23-18/h2-9H,10-11H2,1H3,(H,21,26)(H,22,27)(H,24,28)(H,25,29)