4-oxidanylidene-3-phenyl-N-(3-pyrazol-1-ylpropyl)phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-3-phenyl-N-(3-pyrazol-1-ylpropyl)phthalazine-1-carboxamide Openeye Name: 4-oxo-3-phenyl-N-(3-pyrazol-1-ylpropyl)phthalazine-1-carboxamide CAS Name: 4-oxo-3-phenyl-N-[3-(1-pyrazolyl)propyl]-1-phthalazinecarboxamide IUPAC Name: 4-oxo-3-phenyl-N-(3-pyrazol-1-ylpropyl)phthalazine-1-carboxamide Traditional Name: 4-keto-3-phenyl-N-(3-pyrazol-1-ylpropyl)phthalazine-1-carboxamide Formula: C21H19N5O2 MolecularWeight: 373.40786

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCCCN4C=CC=N4

Isomeric SMILES

C1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3C(=N2)C(=O)NCCCN4C=CC=N4

InChI

InChI=1S/C21H19N5O2/c27-20(22-12-6-14-25-15-7-13-23-25)19-17-10-4-5-11-18(17)21(28)26(24-19)16-8-2-1-3-9-16/h1-5,7-11,13,15H,6,12,14H2,(H,22,27)