4-oxidanylidene-N-[2-(phenylmethyl)pyrazol-3-yl]-3-propyl-phthalazine-1-carboxamide

Systemtic Name: 4-oxidanylidene-N-[2-(phenylmethyl)pyrazol-3-yl]-3-propyl-phthalazine-1-carboxamide Openeye Name: N-(2-benzylpyrazol-3-yl)-4-oxo-3-propyl-phthalazine-1-carboxamide CAS Name: 4-oxo-N-[2-(phenylmethyl)-3-pyrazolyl]-3-propyl-1-phthalazinecarboxamide IUPAC Name: N-(2-benzylpyrazol-3-yl)-4-oxo-3-propylphthalazine-1-carboxamide Traditional Name: N-(2-benzylpyrazol-3-yl)-4-keto-3-propyl-phthalazine-1-carboxamide Formula: C22H21N5O2 MolecularWeight: 387.43444

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=CC=C4

Isomeric SMILES

CCCN1C(=O)C2=CC=CC=C2C(=N1)C(=O)NC3=CC=NN3CC4=CC=CC=C4

InChI

InChI=1S/C22H21N5O2/c1-2-14-26-22(29)18-11-7-6-10-17(18)20(25-26)21(28)24-19-12-13-23-27(19)15-16-8-4-3-5-9-16/h3-13H,2,14-15H2,1H3,(H,24,28)