2-cyano-N-(4-fluorophenyl)-3,3-bis[(2-methylphenyl)methylsulfanyl]prop-2-enamide

Systemtic Name: 2-cyano-N-(4-fluorophenyl)-3,3-bis[(2-methylphenyl)methylsulfanyl]prop-2-enamide Openeye Name: 2-cyano-N-(4-fluorophenyl)-3,3-bis(o-tolylmethylsulfanyl)prop-2-enamide CAS Name: 2-cyano-N-(4-fluorophenyl)-3,3-bis[(2-methylphenyl)methylthio]-2-propenamide IUPAC Name: 2-cyano-N-(4-fluorophenyl)-3,3-bis[(2-methylphenyl)methylsulfanyl]prop-2-enamide Traditional Name: 2-cyano-N-(4-fluorophenyl)-3,3-bis[(2-methylbenzyl)thio]acrylamide Formula: C26H23FN2OS2 MolecularWeight: 462.602023

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CSC(=C(C#N)C(=O)NC2=CC=C(C=C2)F)SCC3=CC=CC=C3C

Isomeric SMILES

CC1=CC=CC=C1CSC(=C(C#N)C(=O)NC2=CC=C(C=C2)F)SCC3=CC=CC=C3C

InChI

InChI=1S/C26H23FN2OS2/c1-18-7-3-5-9-20(18)16-31-26(32-17-21-10-6-4-8-19(21)2)24(15-28)25(30)29-23-13-11-22(27)12-14-23/h3-14H,16-17H2,1-2H3,(H,29,30)