(4-methylphenyl) 3,3-bis[(4-fluorophenyl)sulfanyl]-N-phenyl-propanimidothioate

Systemtic Name: (4-methylphenyl) 3,3-bis[(4-fluorophenyl)sulfanyl]-N-phenyl-propanimidothioate Openeye Name: p-tolyl 3,3-bis[(4-fluorophenyl)sulfanyl]-N-phenyl-propanimidothioate CAS Name: 3,3-bis[(4-fluorophenyl)thio]-N-phenylpropanimidothioic acid (4-methylphenyl) ester IUPAC Name: (4-methylphenyl) 3,3-bis[(4-fluorophenyl)sulfanyl]-N-phenylpropanimidothioate Traditional Name: 3,3-bis[(4-fluorophenyl)thio]-N-phenyl-thiopropionimidic acid p-tolyl ester Formula: C28H23F2NS3 MolecularWeight: 507.680726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)SC(=NC2=CC=CC=C2)CC(SC3=CC=C(C=C3)F)SC4=CC=C(C=C4)F

Isomeric SMILES

CC1=CC=C(C=C1)SC(=NC2=CC=CC=C2)CC(SC3=CC=C(C=C3)F)SC4=CC=C(C=C4)F

InChI

InChI=1S/C28H23F2NS3/c1-20-7-13-24(14-8-20)32-27(31-23-5-3-2-4-6-23)19-28(33-25-15-9-21(29)10-16-25)34-26-17-11-22(30)12-18-26/h2-18,28H,19H2,1H3