3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxamide

Systemtic Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxidanylidene-quinazoline-7-carboxamide Openeye Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-N-(2-furylmethyl)-4-oxo-quinazoline-7-carboxamide CAS Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylthio]-N-(2-furanylmethyl)-4-oxo-7-quinazolinecarboxamide IUPAC Name: 3-cyclohexyl-2-[(2-fluorophenyl)methylsulfanyl]-N-(furan-2-ylmethyl)-4-oxoquinazoline-7-carboxamide Traditional Name: 3-cyclohexyl-2-[(2-fluorobenzyl)thio]-N-(2-furfuryl)-4-keto-quinazoline-7-carboxamide Formula: C27H26FN3O3S MolecularWeight: 491.577043

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CO4)N=C2SCC5=CC=CC=C5F

Isomeric SMILES

C1CCC(CC1)N2C(=O)C3=C(C=C(C=C3)C(=O)NCC4=CC=CO4)N=C2SCC5=CC=CC=C5F

InChI

InChI=1S/C27H26FN3O3S/c28-23-11-5-4-7-19(23)17-35-27-30-24-15-18(25(32)29-16-21-10-6-14-34-21)12-13-22(24)26(33)31(27)20-8-2-1-3-9-20/h4-7,10-15,20H,1-3,8-9,16-17H2,(H,29,32)