N'-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]phenyl]carbonyl-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]phenyl]carbonyl-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-[2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]benzoyl]-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-[[2-[(3,5-dimethyl-4-isoxazolyl)methylthio]phenyl]-oxomethyl]-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzoyl]-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: N'-[2-[(3,5-dimethylisoxazol-4-yl)methylthio]benzoyl]-4-keto-3-propyl-phthalazine-1-carbohydrazide Formula: C25H25N5O4S MolecularWeight: 491.5621

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=CC=C3SCC4=C(ON=C4C)C

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=CC=CC=C3SCC4=C(ON=C4C)C

InChI

InChI=1S/C25H25N5O4S/c1-4-13-30-25(33)18-10-6-5-9-17(18)22(28-30)24(32)27-26-23(31)19-11-7-8-12-21(19)35-14-20-15(2)29-34-16(20)3/h5-12H,4,13-14H2,1-3H3,(H,26,31)(H,27,32)