1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-(methylamino)-4-(methylsulfanylmethyl)pyrazole-3-carbonitrile

Systemtic Name: 1-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-(methylamino)-4-(methylsulfanylmethyl)pyrazole-3-carbonitrile Openeye Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-(methylamino)-4-(methylsulfanylmethyl)pyrazole-3-carbonitrile CAS Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-(methylamino)-4-[(methylthio)methyl]-3-pyrazolecarbonitrile IUPAC Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-(methylamino)-4-(methylsulfanylmethyl)pyrazole-3-carbonitrile Traditional Name: 1-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-(methylamino)-4-[(methylthio)methyl]pyrazole-3-carbonitrile Formula: C14H11Cl2F3N4S MolecularWeight: 395.23015

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C(=NN1C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)C#N)CSC

Isomeric SMILES

CNC1=C(C(=NN1C2=C(C=C(C=C2Cl)C(F)(F)F)Cl)C#N)CSC

InChI

InChI=1S/C14H11Cl2F3N4S/c1-21-13-8(6-24-2)11(5-20)22-23(13)12-9(15)3-7(4-10(12)16)14(17,18)19/h3-4,21H,6H2,1-2H3