N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide

Systemtic Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-oxidanylidene-3-pentyl-phthalazine-1-carbohydrazide Openeye Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-oxo-3-pentyl-phthalazine-1-carbohydrazide CAS Name: N'-[4-(1,3-benzothiazol-2-yl)-1-oxobutyl]-4-oxo-3-pentyl-1-phthalazinecarbohydrazide IUPAC Name: N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-oxo-3-pentylphthalazine-1-carbohydrazide Traditional Name: 3-amyl-N'-[4-(1,3-benzothiazol-2-yl)butanoyl]-4-keto-phthalazine-1-carbohydrazide Formula: C25H27N5O3S MolecularWeight: 477.57858

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCCC3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CCCC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H27N5O3S/c1-2-3-8-16-30-25(33)18-11-5-4-10-17(18)23(29-30)24(32)28-27-21(31)14-9-15-22-26-19-12-6-7-13-20(19)34-22/h4-7,10-13H,2-3,8-9,14-16H2,1H3,(H,27,31)(H,28,32)