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

Systemtic Name: 2-cyano-3,3-bis[(3-methylphenyl)methylsulfanyl]-N-phenyl-prop-2-enamide Openeye Name: 2-cyano-3,3-bis(m-tolylmethylsulfanyl)-N-phenyl-prop-2-enamide CAS Name: 2-cyano-3,3-bis[(3-methylphenyl)methylthio]-N-phenyl-2-propenamide IUPAC Name: 2-cyano-3,3-bis[(3-methylphenyl)methylsulfanyl]-N-phenylprop-2-enamide Traditional Name: 2-cyano-3,3-bis[(3-methylbenzyl)thio]-N-phenyl-acrylamide Formula: C26H24N2OS2 MolecularWeight: 444.61156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)CSC(=C(C#N)C(=O)NC2=CC=CC=C2)SCC3=CC=CC(=C3)C

Isomeric SMILES

CC1=CC(=CC=C1)CSC(=C(C#N)C(=O)NC2=CC=CC=C2)SCC3=CC=CC(=C3)C

InChI

InChI=1S/C26H24N2OS2/c1-19-8-6-10-21(14-19)17-30-26(31-18-22-11-7-9-20(2)15-22)24(16-27)25(29)28-23-12-4-3-5-13-23/h3-15H,17-18H2,1-2H3,(H,28,29)