N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-oxidanylidenequinazolin-3-yl)ethanamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-oxoquinazolin-3-yl)acetamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-2-(4-oxo-3-quinazolinyl)acetamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-oxoquinazolin-3-yl)acetamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-2-(4-ketoquinazolin-3-yl)acetamide Formula: C23H20FN7O2 MolecularWeight: 445.449003

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C=N2)CC(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H20FN7O2/c24-15-7-9-16(10-8-15)31-22(26)18(12-25)20(29-31)6-3-11-27-21(32)13-30-14-28-19-5-2-1-4-17(19)23(30)33/h1-2,4-5,7-10,14H,3,6,11,13,26H2,(H,27,32)