4-cyano-N-[(E)-[1-(4-cyanophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-fluoranyl-benzamide

Systemtic Name: 4-cyano-N-[(E)-[1-(4-cyanophenyl)-2,5-dimethyl-pyrrol-3-yl]methylideneamino]-2-fluoranyl-benzamide Openeye Name: 4-cyano-N-[(E)-[1-(4-cyanophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-fluoro-benzamide CAS Name: 4-cyano-N-[(E)-[1-(4-cyanophenyl)-2,5-dimethyl-3-pyrrolyl]methylideneamino]-2-fluorobenzamide IUPAC Name: 4-cyano-N-[(E)-[1-(4-cyanophenyl)-2,5-dimethylpyrrol-3-yl]methylideneamino]-2-fluorobenzamide Traditional Name: 4-cyano-N-[(E)-[1-(4-cyanophenyl)-2,5-dimethyl-pyrrol-3-yl]methyleneamino]-2-fluoro-benzamide Formula: C22H16FN5O MolecularWeight: 385.393743

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1C2=CC=C(C=C2)C#N)C)C=NNC(=O)C3=C(C=C(C=C3)C#N)F

Isomeric SMILES

CC1=CC(=C(N1C2=CC=C(C=C2)C#N)C)/C=N/NC(=O)C3=C(C=C(C=C3)C#N)F

InChI

InChI=1S/C22H16FN5O/c1-14-9-18(15(2)28(14)19-6-3-16(11-24)4-7-19)13-26-27-22(29)20-8-5-17(12-25)10-21(20)23/h3-10,13H,1-2H3,(H,27,29)/b26-13+