N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-4-(4-oxidanylidene-1H-quinazolin-2-yl)butanamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide CAS Name: N-[4-(difluoromethylthio)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-4-(4-oxo-1H-quinazolin-2-yl)butanamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-4-(4-keto-1H-quinazolin-2-yl)butyramide Formula: C19H17F2N3O2S MolecularWeight: 389.418986

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N=C(N2)CCCC(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N=C(N2)CCCC(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C19H17F2N3O2S/c20-19(21)27-13-10-8-12(9-11-13)22-17(25)7-3-6-16-23-15-5-2-1-4-14(15)18(26)24-16/h1-2,4-5,8-11,19H,3,6-7H2,(H,22,25)(H,23,24,26)