N-methyl-N-[2-oxidanylidene-2-[2-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinyl]ethyl]thiophene-2-sulfonamide

Systemtic Name: N-methyl-N-[2-oxidanylidene-2-[2-(4-oxidanylidene-3-pentyl-phthalazin-1-yl)carbonylhydrazinyl]ethyl]thiophene-2-sulfonamide Openeye Name: N-methyl-N-[2-oxo-2-[2-(4-oxo-3-pentyl-phthalazine-1-carbonyl)hydrazino]ethyl]thiophene-2-sulfonamide CAS Name: N-methyl-N-[2-oxo-2-[[oxo-(4-oxo-3-pentyl-1-phthalazinyl)methyl]hydrazo]ethyl]-2-thiophenesulfonamide IUPAC Name: N-methyl-N-[2-oxo-2-[2-(4-oxo-3-pentylphthalazine-1-carbonyl)hydrazinyl]ethyl]thiophene-2-sulfonamide Traditional Name: N-[2-[N'-(3-amyl-4-keto-phthalazine-1-carbonyl)hydrazino]-2-keto-ethyl]-N-methyl-thiophene-2-sulfonamide Formula: C21H25N5O5S2 MolecularWeight: 491.5837

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN(C)S(=O)(=O)C3=CC=CS3

Isomeric SMILES

CCCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)CN(C)S(=O)(=O)C3=CC=CS3

InChI

InChI=1S/C21H25N5O5S2/c1-3-4-7-12-26-21(29)16-10-6-5-9-15(16)19(24-26)20(28)23-22-17(27)14-25(2)33(30,31)18-11-8-13-32-18/h5-6,8-11,13H,3-4,7,12,14H2,1-2H3,(H,22,27)(H,23,28)