2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]pyrazol-3-amine

Systemtic Name: 2-[2,6-bis(chloranyl)-4-(trifluoromethyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]pyrazol-3-amine Openeye Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]pyrazol-3-amine CAS Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4-fluorophenyl)methylthio]-3-pyrazolamine IUPAC Name: 2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4-fluorophenyl)methylsulfanyl]pyrazol-3-amine Traditional Name: [2-[2,6-dichloro-4-(trifluoromethyl)phenyl]-5-[(4-fluorobenzyl)thio]pyrazol-3-yl]amine Formula: C17H11Cl2F4N3S MolecularWeight: 436.253953

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CSC2=NN(C(=C2)N)C3=C(C=C(C=C3Cl)C(F)(F)F)Cl)F

Isomeric SMILES

C1=CC(=CC=C1CSC2=NN(C(=C2)N)C3=C(C=C(C=C3Cl)C(F)(F)F)Cl)F

InChI

InChI=1S/C17H11Cl2F4N3S/c18-12-5-10(17(21,22)23)6-13(19)16(12)26-14(24)7-15(25-26)27-8-9-1-3-11(20)4-2-9/h1-7H,8,24H2