3-butyl-N'-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-4-oxidanylidene-phthalazine-1-carbohydrazide

Systemtic Name: 3-butyl-N'-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-4-oxidanylidene-phthalazine-1-carbohydrazide Openeye Name: 3-butyl-N'-[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]-4-oxo-phthalazine-1-carbohydrazide CAS Name: 3-butyl-N'-[(E)-2-cyano-2-(4-methyl-2-thiazolyl)ethenyl]-4-oxo-1-phthalazinecarbohydrazide IUPAC Name: 3-butyl-N'-[(E)-2-cyano-2-(4-methyl-1,3-thiazol-2-yl)ethenyl]-4-oxophthalazine-1-carbohydrazide Traditional Name: 3-butyl-N'-[(E)-2-cyano-2-(4-methylthiazol-2-yl)vinyl]-4-keto-phthalazine-1-carbohydrazide Formula: C20H20N6O2S MolecularWeight: 408.4768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC=C(C#N)C3=NC(=CS3)C

Isomeric SMILES

CCCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NN/C=C(\C#N)/C3=NC(=CS3)C

InChI

InChI=1S/C20H20N6O2S/c1-3-4-9-26-20(28)16-8-6-5-7-15(16)17(25-26)18(27)24-22-11-14(10-21)19-23-13(2)12-29-19/h5-8,11-12,22H,3-4,9H2,1-2H3,(H,24,27)/b14-11+