N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-oxidanylidene-3-propyl-phthalazine-1-carbohydrazide Openeye Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-oxo-3-propyl-phthalazine-1-carbohydrazide CAS Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-oxo-3-propyl-1-phthalazinecarbohydrazide IUPAC Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-oxo-3-propylphthalazine-1-carbohydrazide Traditional Name: N'-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-4-keto-3-propyl-phthalazine-1-carbohydrazide Formula: C21H22N4O6S MolecularWeight: 458.48758

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNS(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H22N4O6S/c1-2-10-25-21(27)16-7-4-3-6-15(16)19(23-25)20(26)22-24-32(28,29)14-8-9-17-18(13-14)31-12-5-11-30-17/h3-4,6-9,13,24H,2,5,10-12H2,1H3,(H,22,26)