N-butyl-3-(4-fluorophenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]imidazole-4-carboxamide

Systemtic Name: N-butyl-3-(4-fluorophenyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]imidazole-4-carboxamide Openeye Name: N-butyl-3-(4-fluorophenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]imidazole-4-carboxamide CAS Name: N-butyl-3-(4-fluorophenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-4-imidazolecarboxamide IUPAC Name: N-butyl-3-(4-fluorophenyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]imidazole-4-carboxamide Traditional Name: N-butyl-3-(4-fluorophenyl)-N-[(4-keto-1H-quinazolin-2-yl)methyl]imidazole-4-carboxamide Formula: C23H22FN5O2 MolecularWeight: 419.451483

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CN=CN3C4=CC=C(C=C4)F

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CN=CN3C4=CC=C(C=C4)F

InChI

InChI=1S/C23H22FN5O2/c1-2-3-12-28(14-21-26-19-7-5-4-6-18(19)22(30)27-21)23(31)20-13-25-15-29(20)17-10-8-16(24)9-11-17/h4-11,13,15H,2-3,12,14H2,1H3,(H,26,27,30)