N-cyclohexyl-4-[[2-[(3-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]benzamide

Systemtic Name: N-cyclohexyl-4-[[2-[(3-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]benzamide Openeye Name: N-cyclohexyl-4-[[2-[(3-fluorophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]methyl]benzamide CAS Name: N-cyclohexyl-4-[[2-[(3-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]methyl]benzamide IUPAC Name: N-cyclohexyl-4-[[2-[(3-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]methyl]benzamide Traditional Name: N-cyclohexyl-4-[[2-[(3-fluorobenzyl)thio]-4-keto-quinazolin-3-yl]methyl]benzamide Formula: C29H28FN3O2S MolecularWeight: 501.614923

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)F

Isomeric SMILES

C1CCC(CC1)NC(=O)C2=CC=C(C=C2)CN3C(=O)C4=CC=CC=C4N=C3SCC5=CC(=CC=C5)F

InChI

InChI=1S/C29H28FN3O2S/c30-23-8-6-7-21(17-23)19-36-29-32-26-12-5-4-11-25(26)28(35)33(29)18-20-13-15-22(16-14-20)27(34)31-24-9-2-1-3-10-24/h4-8,11-17,24H,1-3,9-10,18-19H2,(H,31,34)