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

Systemtic Name: 3,3-bis[(2-chloranyl-4-fluoranyl-phenyl)methylsulfanyl]-2-cyano-N-(3-methylphenyl)prop-2-enamide Openeye Name: 3,3-bis[(2-chloro-4-fluoro-phenyl)methylsulfanyl]-2-cyano-N-(m-tolyl)prop-2-enamide CAS Name: 3,3-bis[(2-chloro-4-fluorophenyl)methylthio]-2-cyano-N-(3-methylphenyl)-2-propenamide IUPAC Name: 3,3-bis[(2-chloro-4-fluorophenyl)methylsulfanyl]-2-cyano-N-(3-methylphenyl)prop-2-enamide Traditional Name: 3,3-bis[(2-chloro-4-fluoro-benzyl)thio]-2-cyano-N-(m-tolyl)acrylamide Formula: C25H18Cl2F2N2OS2 MolecularWeight: 535.456026

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(=C(SCC2=C(C=C(C=C2)F)Cl)SCC3=C(C=C(C=C3)F)Cl)C#N

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)C(=C(SCC2=C(C=C(C=C2)F)Cl)SCC3=C(C=C(C=C3)F)Cl)C#N

InChI

InChI=1S/C25H18Cl2F2N2OS2/c1-15-3-2-4-20(9-15)31-24(32)21(12-30)25(33-13-16-5-7-18(28)10-22(16)26)34-14-17-6-8-19(29)11-23(17)27/h2-11H,13-14H2,1H3,(H,31,32)