3-[bis(fluoranyl)methyl]-5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)pyrazole

Systemtic Name: 3-[bis(fluoranyl)methyl]-5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)pyrazole Openeye Name: 3-(difluoromethyl)-5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)pyrazole CAS Name: 3-(difluoromethyl)-5-[4-(methylthio)phenyl]-1-(4-nitrophenyl)pyrazole IUPAC Name: 3-(difluoromethyl)-5-(4-methylsulfanylphenyl)-1-(4-nitrophenyl)pyrazole Traditional Name: 3-(difluoromethyl)-5-[4-(methylthio)phenyl]-1-(4-nitrophenyl)pyrazole Formula: C17H13F2N3O2S MolecularWeight: 361.365826

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)F

Isomeric SMILES

CSC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)[N+](=O)[O-])C(F)F

InChI

InChI=1S/C17H13F2N3O2S/c1-25-14-8-2-11(3-9-14)16-10-15(17(18)19)20-21(16)12-4-6-13(7-5-12)22(23)24/h2-10,17H,1H3