N-(4-fluorophenyl)-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-(4-fluorophenyl)-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-(4-fluorophenyl)-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-(4-fluorophenyl)-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-(4-fluorophenyl)-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-(4-fluorophenyl)-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)hexanamide Formula: C20H20FN3O2S MolecularWeight: 385.455103

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NC3=CC=C(C=C3)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=S)N2)CCCCCC(=O)NC3=CC=C(C=C3)F

InChI

InChI=1S/C20H20FN3O2S/c21-14-9-11-15(12-10-14)22-18(25)8-2-1-5-13-24-19(26)16-6-3-4-7-17(16)23-20(24)27/h3-4,6-7,9-12H,1-2,5,8,13H2,(H,22,25)(H,23,27)