4-(4-propylcyclohexyl)-3-[2,3,4-tris(fluoranyl)phenyl]cyclohexane-1-carbothioate

Systemtic Name: 4-(4-propylcyclohexyl)-3-[2,3,4-tris(fluoranyl)phenyl]cyclohexane-1-carbothioate Openeye Name: 4-(4-propylcyclohexyl)-3-(2,3,4-trifluorophenyl)cyclohexanecarbothioate CAS Name: 4-(4-propylcyclohexyl)-3-(2,3,4-trifluorophenyl)-1-cyclohexanecarbothioate IUPAC Name: 4-(4-propylcyclohexyl)-3-(2,3,4-trifluorophenyl)cyclohexane-1-carbothioate Traditional Name: 4-(4-propylcyclohexyl)-3-(2,3,4-trifluorophenyl)cyclohexanecarbothioate Formula: C22H28F3OS- MolecularWeight: 397.51733

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1CCC(CC1)C2CCC(CC2C3=C(C(=C(C=C3)F)F)F)C(=S)[O-]

Isomeric SMILES

CCCC1CCC(CC1)C2CCC(CC2C3=C(C(=C(C=C3)F)F)F)C(=S)[O-]

InChI

InChI=1S/C22H29F3OS/c1-2-3-13-4-6-14(7-5-13)16-9-8-15(22(26)27)12-18(16)17-10-11-19(23)21(25)20(17)24/h10-11,13-16,18H,2-9,12H2,1H3,(H,26,27)/p-1