N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide

Systemtic Name: N-[3-(5-azanyl-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-oxidanylidene-3H-phthalazin-1-yl)ethanamide Openeye Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide CAS Name: N-[3-(5-amino-4-cyano-1-phenyl-3-pyrazolyl)propyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide IUPAC Name: N-[3-(5-amino-4-cyano-1-phenylpyrazol-3-yl)propyl]-2-(4-oxo-3H-phthalazin-1-yl)acetamide Traditional Name: N-[3-(5-amino-4-cyano-1-phenyl-pyrazol-3-yl)propyl]-2-(4-keto-3H-phthalazin-1-yl)acetamide Formula: C23H21N7O2 MolecularWeight: 427.45854

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)CC3=NNC(=O)C4=CC=CC=C43)C#N)N

Isomeric SMILES

C1=CC=C(C=C1)N2C(=C(C(=N2)CCCNC(=O)CC3=NNC(=O)C4=CC=CC=C43)C#N)N

InChI

InChI=1S/C23H21N7O2/c24-14-18-19(29-30(22(18)25)15-7-2-1-3-8-15)11-6-12-26-21(31)13-20-16-9-4-5-10-17(16)23(32)28-27-20/h1-5,7-10H,6,11-13,25H2,(H,26,31)(H,28,32)