N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide

Systemtic Name: N-[3-[5-azanyl-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)butanamide Openeye Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-4-(2-methyl-4-oxo-quinazolin-3-yl)butanamide CAS Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)-3-pyrazolyl]propyl]-4-(2-methyl-4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-4-(2-methyl-4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[3-[5-amino-4-cyano-1-(4-fluorophenyl)pyrazol-3-yl]propyl]-4-(4-keto-2-methyl-quinazolin-3-yl)butyramide Formula: C26H26FN7O2 MolecularWeight: 487.528743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1CCCC(=O)NCCCC3=NN(C(=C3C#N)N)C4=CC=C(C=C4)F

InChI

InChI=1S/C26H26FN7O2/c1-17-31-22-7-3-2-6-20(22)26(36)33(17)15-5-9-24(35)30-14-4-8-23-21(16-28)25(29)34(32-23)19-12-10-18(27)11-13-19/h2-3,6-7,10-13H,4-5,8-9,14-15,29H2,1H3,(H,30,35)