N'-[1-(3,5-dimethylphenyl)carbonylpiperidin-3-yl]carbonyl-3-ethyl-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: N'-[1-(3,5-dimethylphenyl)carbonylpiperidin-3-yl]carbonyl-3-ethyl-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: N'-[1-(3,5-dimethylbenzoyl)piperidine-3-carbonyl]-3-ethyl-4-oxo-phthalazine-1-carbohydrazide CAS Name: N'-[[1-[(3,5-dimethylphenyl)-oxomethyl]-3-piperidinyl]-oxomethyl]-3-ethyl-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: N'-[1-(3,5-dimethylbenzoyl)piperidine-3-carbonyl]-3-ethyl-4-oxophthalazine-1-carbohydrazide Traditional Name: N'-[1-(3,5-dimethylbenzoyl)nipecotoyl]-3-ethyl-4-keto-phthalazine-1-carbohydrazide Formula: C26H29N5O4 MolecularWeight: 475.53956

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CCCN(C3)C(=O)C4=CC(=CC(=C4)C)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3CCCN(C3)C(=O)C4=CC(=CC(=C4)C)C

InChI

InChI=1S/C26H29N5O4/c1-4-31-26(35)21-10-6-5-9-20(21)22(29-31)24(33)28-27-23(32)18-8-7-11-30(15-18)25(34)19-13-16(2)12-17(3)14-19/h5-6,9-10,12-14,18H,4,7-8,11,15H2,1-3H3,(H,27,32)(H,28,33)