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

Systemtic Name: 2-cyano-3,3-bis[(3-nitrophenyl)methylsulfanyl]-N-phenyl-prop-2-enamide Openeye Name: 2-cyano-3,3-bis[(3-nitrophenyl)methylsulfanyl]-N-phenyl-prop-2-enamide CAS Name: 2-cyano-3,3-bis[(3-nitrophenyl)methylthio]-N-phenyl-2-propenamide IUPAC Name: 2-cyano-3,3-bis[(3-nitrophenyl)methylsulfanyl]-N-phenylprop-2-enamide Traditional Name: 2-cyano-3,3-bis[(3-nitrobenzyl)thio]-N-phenyl-acrylamide Formula: C24H18N4O5S2 MolecularWeight: 506.55352

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C(=C(SCC2=CC(=CC=C2)[N+](=O)[O-])SCC3=CC(=CC=C3)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C(=C(SCC2=CC(=CC=C2)[N+](=O)[O-])SCC3=CC(=CC=C3)[N+](=O)[O-])C#N

InChI

InChI=1S/C24H18N4O5S2/c25-14-22(23(29)26-19-8-2-1-3-9-19)24(34-15-17-6-4-10-20(12-17)27(30)31)35-16-18-7-5-11-21(13-18)28(32)33/h1-13H,15-16H2,(H,26,29)