4-[bis(fluoranyl)methylsulfanyl]-N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide

Systemtic Name: 4-[bis(fluoranyl)methylsulfanyl]-N-(2-methoxyethyl)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]benzamide Openeye Name: 4-(difluoromethylsulfanyl)-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide CAS Name: 4-(difluoromethylthio)-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide IUPAC Name: 4-(difluoromethylsulfanyl)-N-(2-methoxyethyl)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]benzamide Traditional Name: 4-(difluoromethylthio)-N-[(4-keto-1H-quinazolin-2-yl)methyl]-N-(2-methoxyethyl)benzamide Formula: C20H19F2N3O3S MolecularWeight: 419.444966

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)SC(F)F

Isomeric SMILES

COCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C20H19F2N3O3S/c1-28-11-10-25(19(27)13-6-8-14(9-7-13)29-20(21)22)12-17-23-16-5-3-2-4-15(16)18(26)24-17/h2-9,20H,10-12H2,1H3,(H,23,24,26)