7-[bis(fluoranyl)methylsulfanyl]-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one

Systemtic Name: 7-[bis(fluoranyl)methylsulfanyl]-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-(difluoromethylsulfanyl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-(difluoromethylthio)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-(difluoromethylsulfanyl)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-(difluoromethylthio)-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C16H12F2N2OS MolecularWeight: 318.341086

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)NC2=C(C=C(C=C2)SC(F)F)C(=N1)C3=CC=CC=C3

Isomeric SMILES

C1C(=O)NC2=C(C=C(C=C2)SC(F)F)C(=N1)C3=CC=CC=C3

InChI

InChI=1S/C16H12F2N2OS/c17-16(18)22-11-6-7-13-12(8-11)15(19-9-14(21)20-13)10-4-2-1-3-5-10/h1-8,16H,9H2,(H,20,21)