N'-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: N'-[4-(2,5-dimethylthiophen-3-yl)-4-oxidanylidene-butanoyl]-3-ethyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: N'-[4-(2,5-dimethyl-3-thienyl)-4-oxo-butanoyl]-3-ethyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[4-(2,5-dimethyl-3-thiophenyl)-1,4-dioxobutyl]-3-ethyl-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: N'-[4-(2,5-dimethylthiophen-3-yl)-4-oxobutanoyl]-3-ethyl-4-oxophthalazine-1-carbohydrazide Traditional Name: N'-[4-(2,5-dimethyl-3-thienyl)-4-keto-butanoyl]-3-ethyl-4-keto-phthalazine-1-carbohydrazide Formula: C21H22N4O4S MolecularWeight: 426.48878

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCC(=O)C3=C(SC(=C3)C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCC(=O)C3=C(SC(=C3)C)C

InChI

InChI=1S/C21H22N4O4S/c1-4-25-21(29)15-8-6-5-7-14(15)19(24-25)20(28)23-22-18(27)10-9-17(26)16-11-12(2)30-13(16)3/h5-8,11H,4,9-10H2,1-3H3,(H,22,27)(H,23,28)