2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Openeye Name: 2-[7-chloro-4-oxo-3-(tetrahydrofuran-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide CAS Name: 2-[[7-chloro-4-oxo-3-(2-oxolanylmethyl)-2-quinazolinyl]thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 2-[7-chloro-4-oxo-3-(oxolan-2-ylmethyl)quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Traditional Name: 2-[[7-chloro-4-keto-3-(tetrahydrofurfuryl)quinazolin-2-yl]thio]-N-(4-fluorophenyl)propionamide Formula: C22H21ClFN3O3S MolecularWeight: 461.936843

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)F)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)F)SC2=NC3=C(C=CC(=C3)Cl)C(=O)N2CC4CCCO4

InChI

InChI=1S/C22H21ClFN3O3S/c1-13(20(28)25-16-7-5-15(24)6-8-16)31-22-26-19-11-14(23)4-9-18(19)21(29)27(22)12-17-3-2-10-30-17/h4-9,11,13,17H,2-3,10,12H2,1H3,(H,25,28)