2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide

Systemtic Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide Openeye Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide CAS Name: 2-[[4-(cyclopropylamino)-2-quinazolinyl]thio]-N-[1-(4-fluorophenyl)ethyl]propanamide IUPAC Name: 2-[4-(cyclopropylamino)quinazolin-2-yl]sulfanyl-N-[1-(4-fluorophenyl)ethyl]propanamide Traditional Name: 2-[[4-(cyclopropylamino)quinazolin-2-yl]thio]-N-[1-(4-fluorophenyl)ethyl]propionamide Formula: C22H23FN4OS MolecularWeight: 410.507623

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)F)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=N2)NC4CC4

Isomeric SMILES

CC(C1=CC=C(C=C1)F)NC(=O)C(C)SC2=NC3=CC=CC=C3C(=N2)NC4CC4

InChI

InChI=1S/C22H23FN4OS/c1-13(15-7-9-16(23)10-8-15)24-21(28)14(2)29-22-26-19-6-4-3-5-18(19)20(27-22)25-17-11-12-17/h3-10,13-14,17H,11-12H2,1-2H3,(H,24,28)(H,25,26,27)