2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-bis(2-methylpropyl)ethanamide

Systemtic Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxidanylidene-quinazolin-2-yl]sulfanyl-N,N-bis(2-methylpropyl)ethanamide Openeye Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxo-quinazolin-2-yl]sulfanyl-N,N-diisobutyl-acetamide CAS Name: 2-[[3-[(4-fluorophenyl)methyl]-4-oxo-2-quinazolinyl]thio]-N,N-bis(2-methylpropyl)acetamide IUPAC Name: 2-[3-[(4-fluorophenyl)methyl]-4-oxoquinazolin-2-yl]sulfanyl-N,N-bis(2-methylpropyl)acetamide Traditional Name: 2-[[3-(4-fluorobenzyl)-4-keto-quinazolin-2-yl]thio]-N,N-diisobutyl-acetamide Formula: C25H30FN3O2S MolecularWeight: 455.588003

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)CSC1=NC2=CC=CC=C2C(=O)N1CC3=CC=C(C=C3)F

InChI

InChI=1S/C25H30FN3O2S/c1-17(2)13-28(14-18(3)4)23(30)16-32-25-27-22-8-6-5-7-21(22)24(31)29(25)15-19-9-11-20(26)12-10-19/h5-12,17-18H,13-16H2,1-4H3