N-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-3-(4-fluorophenyl)sulfanyl-propanamide

Systemtic Name: N-[(6,7-dimethoxy-4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-ethyl-3-(4-fluorophenyl)sulfanyl-propanamide Openeye Name: N-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-3-(4-fluorophenyl)sulfanyl-propanamide CAS Name: N-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-3-[(4-fluorophenyl)thio]propanamide IUPAC Name: N-[(6,7-dimethoxy-4-oxo-1H-quinazolin-2-yl)methyl]-N-ethyl-3-(4-fluorophenyl)sulfanylpropanamide Traditional Name: N-ethyl-3-[(4-fluorophenyl)thio]-N-[(4-keto-6,7-dimethoxy-1H-quinazolin-2-yl)methyl]propionamide Formula: C22H24FN3O4S MolecularWeight: 445.507063

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=O)CCSC3=CC=C(C=C3)F

Isomeric SMILES

CCN(CC1=NC(=O)C2=CC(=C(C=C2N1)OC)OC)C(=O)CCSC3=CC=C(C=C3)F

InChI

InChI=1S/C22H24FN3O4S/c1-4-26(21(27)9-10-31-15-7-5-14(23)6-8-15)13-20-24-17-12-19(30-3)18(29-2)11-16(17)22(28)25-20/h5-8,11-12H,4,9-10,13H2,1-3H3,(H,24,25,28)