N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[2-[(2-fluorophenyl)methylthio]ethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[2-[(2-fluorophenyl)methylsulfanyl]ethyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[2-[(2-fluorobenzyl)thio]ethyl]-3-(4-keto-1H-quinazolin-2-yl)propionamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CSCCNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)F

Isomeric SMILES

C1=CC=C(C(=C1)CSCCNC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)F

InChI

InChI=1S/C20H20FN3O2S/c21-16-7-3-1-5-14(16)13-27-12-11-22-19(25)10-9-18-23-17-8-4-2-6-15(17)20(26)24-18/h1-8H,9-13H2,(H,22,25)(H,23,24,26)