N-[5-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]carbamoyl]-4-methyl-thiophen-2-yl]furan-2-carboxamide

Systemtic Name: N-[5-[[(3-ethyl-4-oxidanylidene-phthalazin-1-yl)carbonylamino]carbamoyl]-4-methyl-thiophen-2-yl]furan-2-carboxamide Openeye Name: N-[5-[[(3-ethyl-4-oxo-phthalazine-1-carbonyl)amino]carbamoyl]-4-methyl-2-thienyl]furan-2-carboxamide CAS Name: N-[5-[[[(3-ethyl-4-oxo-1-phthalazinyl)-oxomethyl]hydrazo]-oxomethyl]-4-methyl-2-thiophenyl]-2-furancarboxamide IUPAC Name: N-[5-[[(3-ethyl-4-oxophthalazine-1-carbonyl)amino]carbamoyl]-4-methylthiophen-2-yl]furan-2-carboxamide Traditional Name: N-[5-[[(3-ethyl-4-keto-phthalazine-1-carbonyl)amino]carbamoyl]-4-methyl-2-thienyl]-2-furamide Formula: C22H19N5O5S MolecularWeight: 465.48176

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C=C(S3)NC(=O)C4=CC=CO4)C

Isomeric SMILES

CCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NNC(=O)C3=C(C=C(S3)NC(=O)C4=CC=CO4)C

InChI

InChI=1S/C22H19N5O5S/c1-3-27-22(31)14-8-5-4-7-13(14)17(26-27)20(29)24-25-21(30)18-12(2)11-16(33-18)23-19(28)15-9-6-10-32-15/h4-11H,3H2,1-2H3,(H,23,28)(H,24,29)(H,25,30)