5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethylsulfanyl)phenyl]pyrazole-3-carbonitrile

Systemtic Name: 5-azanyl-1-[2,6-bis(chloranyl)-4-(trifluoromethylsulfanyl)phenyl]pyrazole-3-carbonitrile Openeye Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethylsulfanyl)phenyl]pyrazole-3-carbonitrile CAS Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethylthio)phenyl]-3-pyrazolecarbonitrile IUPAC Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethylsulfanyl)phenyl]pyrazole-3-carbonitrile Traditional Name: 5-amino-1-[2,6-dichloro-4-(trifluoromethylthio)phenyl]pyrazole-3-carbonitrile Formula: C11H5Cl2F3N4S MolecularWeight: 353.15041

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)N2C(=CC(=N2)C#N)N)Cl)SC(F)(F)F

Isomeric SMILES

C1=C(C=C(C(=C1Cl)N2C(=CC(=N2)C#N)N)Cl)SC(F)(F)F

InChI

InChI=1S/C11H5Cl2F3N4S/c12-7-2-6(21-11(14,15)16)3-8(13)10(7)20-9(18)1-5(4-17)19-20/h1-3H,18H2