4-(3-azanyl-6-oxidanylidene-1H-pyrazolo[4,3-c]pyridazin-5-yl)-N-(2-oxidanyl-1-phenyl-ethyl)butanamide

Systemtic Name: 4-(3-azanyl-6-oxidanylidene-1H-pyrazolo[4,3-c]pyridazin-5-yl)-N-(2-oxidanyl-1-phenyl-ethyl)butanamide Openeye Name: 4-(3-amino-6-oxo-1H-pyrazolo[4,3-c]pyridazin-5-yl)-N-(2-hydroxy-1-phenyl-ethyl)butanamide CAS Name: 4-(3-amino-6-oxo-1H-pyrazolo[4,3-c]pyridazin-5-yl)-N-(2-hydroxy-1-phenylethyl)butanamide IUPAC Name: 4-(3-amino-6-oxo-1H-pyrazolo[4,3-c]pyridazin-5-yl)-N-(2-hydroxy-1-phenylethyl)butanamide Traditional Name: 4-(3-amino-6-keto-1H-pyrazolo[4,3-c]pyridazin-5-yl)-N-(2-hydroxy-1-phenyl-ethyl)butyramide Formula: C17H20N6O3 MolecularWeight: 356.3791

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CO)NC(=O)CCCN2C(=O)C=C3C(=N2)C(=NN3)N

Isomeric SMILES

C1=CC=C(C=C1)C(CO)NC(=O)CCCN2C(=O)C=C3C(=N2)C(=NN3)N

InChI

InChI=1S/C17H20N6O3/c18-17-16-12(20-21-17)9-15(26)23(22-16)8-4-7-14(25)19-13(10-24)11-5-2-1-3-6-11/h1-3,5-6,9,13,20,24H,4,7-8,10H2,(H2,18,21)(H,19,25)