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

Systemtic Name: 2-[7-chloranyl-4-oxidanylidene-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Openeye Name: 2-[7-chloro-3-(3-isopropoxypropyl)-4-oxo-quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide CAS Name: 2-[[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)-2-quinazolinyl]thio]-N-(4-fluorophenyl)propanamide IUPAC Name: 2-[7-chloro-4-oxo-3-(3-propan-2-yloxypropyl)quinazolin-2-yl]sulfanyl-N-(4-fluorophenyl)propanamide Traditional Name: 2-[[7-chloro-3-(3-isopropoxypropyl)-4-keto-quinazolin-2-yl]thio]-N-(4-fluorophenyl)propionamide Formula: C23H25ClFN3O3S MolecularWeight: 477.979303

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

CC(C)OCCCN1C(=O)C2=C(C=C(C=C2)Cl)N=C1SC(C)C(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C23H25ClFN3O3S/c1-14(2)31-12-4-11-28-22(30)19-10-5-16(24)13-20(19)27-23(28)32-15(3)21(29)26-18-8-6-17(25)7-9-18/h5-10,13-15H,4,11-12H2,1-3H3,(H,26,29)