4-[[2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide

Systemtic Name: 4-[[2-[(2-fluorophenyl)methylsulfanyl]-4-oxidanylidene-quinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide Openeye Name: 4-[[2-[(2-fluorophenyl)methylsulfanyl]-4-oxo-quinazolin-3-yl]methyl]-N-(2-furylmethyl)cyclohexanecarboxamide CAS Name: 4-[[2-[(2-fluorophenyl)methylthio]-4-oxo-3-quinazolinyl]methyl]-N-(2-furanylmethyl)-1-cyclohexanecarboxamide IUPAC Name: 4-[[2-[(2-fluorophenyl)methylsulfanyl]-4-oxoquinazolin-3-yl]methyl]-N-(furan-2-ylmethyl)cyclohexane-1-carboxamide Traditional Name: 4-[[2-[(2-fluorobenzyl)thio]-4-keto-quinazolin-3-yl]methyl]-N-(2-furfuryl)cyclohexanecarboxamide Formula: C28H28FN3O3S MolecularWeight: 505.603623

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4F)C(=O)NCC5=CC=CO5

Isomeric SMILES

C1CC(CCC1CN2C(=O)C3=CC=CC=C3N=C2SCC4=CC=CC=C4F)C(=O)NCC5=CC=CO5

InChI

InChI=1S/C28H28FN3O3S/c29-24-9-3-1-6-21(24)18-36-28-31-25-10-4-2-8-23(25)27(34)32(28)17-19-11-13-20(14-12-19)26(33)30-16-22-7-5-15-35-22/h1-10,15,19-20H,11-14,16-18H2,(H,30,33)