N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide

Systemtic Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-(4-oxidanylidenequinazolin-3-yl)butanamide Openeye Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-(4-oxoquinazolin-3-yl)butanamide CAS Name: N-[5-tert-butyl-2-(4-fluorophenyl)-3-pyrazolyl]-4-(4-oxo-3-quinazolinyl)butanamide IUPAC Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-(4-oxoquinazolin-3-yl)butanamide Traditional Name: N-[5-tert-butyl-2-(4-fluorophenyl)pyrazol-3-yl]-4-(4-ketoquinazolin-3-yl)butyramide Formula: C25H26FN5O2 MolecularWeight: 447.504643

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)F

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)NC(=O)CCCN2C=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C25H26FN5O2/c1-25(2,3)21-15-22(31(29-21)18-12-10-17(26)11-13-18)28-23(32)9-6-14-30-16-27-20-8-5-4-7-19(20)24(30)33/h4-5,7-8,10-13,15-16H,6,9,14H2,1-3H3,(H,28,32)