N-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide

Systemtic Name: N-[[2,4-bis(fluoranyl)phenyl]methyl]-N-methyl-6-(4-oxidanylidene-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Openeye Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-6-(4-oxo-2-thioxo-1H-quinazolin-3-yl)hexanamide CAS Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide IUPAC Name: N-[(2,4-difluorophenyl)methyl]-N-methyl-6-(4-oxo-2-sulfanylidene-1H-quinazolin-3-yl)hexanamide Traditional Name: N-(2,4-difluorobenzyl)-6-(4-keto-2-thioxo-1H-quinazolin-3-yl)-N-methyl-hexanamide Formula: C22H23F2N3O2S MolecularWeight: 431.498726

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=C(C=C(C=C1)F)F)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

Isomeric SMILES

CN(CC1=C(C=C(C=C1)F)F)C(=O)CCCCCN2C(=O)C3=CC=CC=C3NC2=S

InChI

InChI=1S/C22H23F2N3O2S/c1-26(14-15-10-11-16(23)13-18(15)24)20(28)9-3-2-6-12-27-21(29)17-7-4-5-8-19(17)25-22(27)30/h4-5,7-8,10-11,13H,2-3,6,9,12,14H2,1H3,(H,25,30)