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

Systemtic Name: 7-[bis(fluoranyl)methylsulfanyl]-3-oxidanyl-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Openeye Name: 7-(difluoromethylsulfanyl)-3-hydroxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one CAS Name: 7-(difluoromethylthio)-3-hydroxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one IUPAC Name: 7-(difluoromethylsulfanyl)-3-hydroxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Traditional Name: 7-(difluoromethylthio)-3-hydroxy-5-phenyl-1,3-dihydro-1,4-benzodiazepin-2-one Formula: C16H12F2N2O2S MolecularWeight: 334.340486

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)SC(F)F)O

Isomeric SMILES

C1=CC=C(C=C1)C2=NC(C(=O)NC3=C2C=C(C=C3)SC(F)F)O

InChI

InChI=1S/C16H12F2N2O2S/c17-16(18)23-10-6-7-12-11(8-10)13(9-4-2-1-3-5-9)20-15(22)14(21)19-12/h1-8,15-16,22H,(H,19,21)