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

Systemtic Name: N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxidanylidene-3-(phenylmethyl)phthalazine-1-carboxamide Openeye Name: 3-benzyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxo-phthalazine-1-carboxamide CAS Name: N-[3-(3,5-dimethyl-1-pyrazolyl)propyl]-4-oxo-3-(phenylmethyl)-1-phthalazinecarboxamide IUPAC Name: 3-benzyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-oxophthalazine-1-carboxamide Traditional Name: 3-benzyl-N-[3-(3,5-dimethylpyrazol-1-yl)propyl]-4-keto-phthalazine-1-carboxamide Formula: C24H25N5O2 MolecularWeight: 415.4876

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C

Isomeric SMILES

CC1=CC(=NN1CCCNC(=O)C2=NN(C(=O)C3=CC=CC=C32)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H25N5O2/c1-17-15-18(2)28(26-17)14-8-13-25-23(30)22-20-11-6-7-12-21(20)24(31)29(27-22)16-19-9-4-3-5-10-19/h3-7,9-12,15H,8,13-14,16H2,1-2H3,(H,25,30)