N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxidanylidene-3-phenyl-phthalazine-1-carboxamide Openeye Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxo-3-phenyl-phthalazine-1-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-4-oxo-3-phenyl-1-phthalazinecarboxamide IUPAC Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxo-3-phenylphthalazine-1-carboxamide Traditional Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-keto-3-phenyl-phthalazine-1-carboxamide Formula: C23H23N5O2 MolecularWeight: 401.46102

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)C4=CC=CC=C4)C

InChI

InChI=1S/C23H23N5O2/c1-16-15-17(2)27(25-16)14-8-13-24-22(29)21-19-11-6-7-12-20(19)23(30)28(26-21)18-9-4-3-5-10-18/h3-7,9-12,15H,8,13-14H2,1-2H3,(H,24,29)