N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide

Systemtic Name: N-[4-[bis(fluoranyl)methylsulfanyl]phenyl]-2-(2-methylquinazolin-4-yl)sulfanyl-ethanamide Openeye Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-(2-methylquinazolin-4-yl)sulfanyl-acetamide CAS Name: N-[4-(difluoromethylthio)phenyl]-2-[(2-methyl-4-quinazolinyl)thio]acetamide IUPAC Name: N-[4-(difluoromethylsulfanyl)phenyl]-2-(2-methylquinazolin-4-yl)sulfanylacetamide Traditional Name: N-[4-(difluoromethylthio)phenyl]-2-[(2-methylquinazolin-4-yl)thio]acetamide Formula: C18H15F2N3OS2 MolecularWeight: 391.458006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=CC=C(C=C3)SC(F)F

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=N1)SCC(=O)NC3=CC=C(C=C3)SC(F)F

InChI

InChI=1S/C18H15F2N3OS2/c1-11-21-15-5-3-2-4-14(15)17(22-11)25-10-16(24)23-12-6-8-13(9-7-12)26-18(19)20/h2-9,18H,10H2,1H3,(H,23,24)