1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-5-pyrrol-1-yl-pyrazole-3-carbonitrile

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-5-pyrrol-1-yl-pyrazole-3-carbonitrile Openeye Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-5-pyrrol-1-yl-pyrazole-3-carbonitrile CAS Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-5-(1-pyrrolyl)-3-pyrazolecarbonitrile IUPAC Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-methylsulfonyl-5-pyrrol-1-ylpyrazole-3-carbonitrile Traditional Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-4-mesyl-5-pyrrol-1-yl-pyrazole-3-carbonitrile Formula: C16H9Cl2F3N4O2S MolecularWeight: 449.23447

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N3C=CC=C3

Isomeric SMILES

CS(=O)(=O)C1=C(N(N=C1C#N)C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)N3C=CC=C3

InChI

InChI=1S/C16H9Cl2F3N4O2S/c1-28(26,27)14-12(8-22)23-25(15(14)24-4-2-3-5-24)13-10(17)6-9(7-11(13)18)16(19,20)21/h2-7H,1H3