[5-methyl-4-[2,3,4,5,6-pentakis(fluoranyl)phenyl]sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloranylbenzoate

Systemtic Name: [5-methyl-4-[2,3,4,5,6-pentakis(fluoranyl)phenyl]sulfanyl-2-phenyl-pyrazol-3-yl] 2-chloranylbenzoate Openeye Name: [5-methyl-4-(2,3,4,5,6-pentafluorophenyl)sulfanyl-2-phenyl-pyrazol-3-yl] 2-chlorobenzoate CAS Name: 2-chlorobenzoic acid [5-methyl-4-[(2,3,4,5,6-pentafluorophenyl)thio]-2-phenyl-3-pyrazolyl] ester IUPAC Name: [5-methyl-4-(2,3,4,5,6-pentafluorophenyl)sulfanyl-2-phenylpyrazol-3-yl] 2-chlorobenzoate Traditional Name: 2-chlorobenzoic acid [5-methyl-4-[(2,3,4,5,6-pentafluorophenyl)thio]-2-phenyl-pyrazol-3-yl] ester Formula: C23H12ClF5N2O2S MolecularWeight: 510.863596

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1SC2=C(C(=C(C(=C2F)F)F)F)F)OC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1SC2=C(C(=C(C(=C2F)F)F)F)F)OC(=O)C3=CC=CC=C3Cl)C4=CC=CC=C4

InChI

InChI=1S/C23H12ClF5N2O2S/c1-11-20(34-21-18(28)16(26)15(25)17(27)19(21)29)22(31(30-11)12-7-3-2-4-8-12)33-23(32)13-9-5-6-10-14(13)24/h2-10H,1H3