(E)-2-cyano-N-(2,4-dimethylphenyl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enamide

Systemtic Name: (E)-2-cyano-N-(2,4-dimethylphenyl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enamide Openeye Name: (E)-2-cyano-N-(2,4-dimethylphenyl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enamide CAS Name: (E)-2-cyano-N-(2,4-dimethylphenyl)-3-(3-phenyl-2,1-benzoxazol-5-yl)-2-propenamide IUPAC Name: (E)-2-cyano-N-(2,4-dimethylphenyl)-3-(3-phenyl-2,1-benzoxazol-5-yl)prop-2-enamide Traditional Name: (E)-2-cyano-N-(2,4-dimethylphenyl)-3-(3-phenylanthranil-5-yl)acrylamide Formula: C25H19N3O2 MolecularWeight: 393.43726

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)C(=CC2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)C#N)C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)/C(=C/C2=CC3=C(ON=C3C=C2)C4=CC=CC=C4)/C#N)C

InChI

InChI=1S/C25H19N3O2/c1-16-8-10-22(17(2)12-16)27-25(29)20(15-26)13-18-9-11-23-21(14-18)24(30-28-23)19-6-4-3-5-7-19/h3-14H,1-2H3,(H,27,29)/b20-13+