5-azanyl-3-[(Z)-1-cyano-2-(3-phenyl-2,1-benzoxazol-5-yl)ethenyl]-1-phenyl-pyrazole-4-carbonitrile

Systemtic Name: 5-azanyl-3-[(Z)-1-cyano-2-(3-phenyl-2,1-benzoxazol-5-yl)ethenyl]-1-phenyl-pyrazole-4-carbonitrile Openeye Name: 5-amino-3-[(Z)-1-cyano-2-(3-phenyl-2,1-benzoxazol-5-yl)vinyl]-1-phenyl-pyrazole-4-carbonitrile CAS Name: 5-amino-3-[(Z)-1-cyano-2-(3-phenyl-2,1-benzoxazol-5-yl)ethenyl]-1-phenyl-4-pyrazolecarbonitrile IUPAC Name: 5-amino-3-[(Z)-1-cyano-2-(3-phenyl-2,1-benzoxazol-5-yl)ethenyl]-1-phenylpyrazole-4-carbonitrile Traditional Name: 5-amino-3-[(Z)-1-cyano-2-(3-phenylanthranil-5-yl)vinyl]-1-phenyl-pyrazole-4-carbonitrile Formula: C26H16N6O MolecularWeight: 428.44484

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C=C(C#N)C4=NN(C(=C4C#N)N)C5=CC=CC=C5

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)/C=C(\C#N)/C4=NN(C(=C4C#N)N)C5=CC=CC=C5

InChI

InChI=1S/C26H16N6O/c27-15-19(24-22(16-28)26(29)32(30-24)20-9-5-2-6-10-20)13-17-11-12-23-21(14-17)25(33-31-23)18-7-3-1-4-8-18/h1-14H,29H2/b19-13+