N-(2-aminophenyl)-4-[[[(Z)-2-cyano-1-(pyridin-4-ylamino)ethenyl]amino]methyl]benzamide

Systemtic Name: N-(2-aminophenyl)-4-[[[(Z)-2-cyano-1-(pyridin-4-ylamino)ethenyl]amino]methyl]benzamide Openeye Name: N-(2-aminophenyl)-4-[[[(Z)-2-cyano-1-(4-pyridylamino)vinyl]amino]methyl]benzamide CAS Name: N-(2-aminophenyl)-4-[[[(Z)-2-cyano-1-(pyridin-4-ylamino)ethenyl]amino]methyl]benzamide IUPAC Name: N-(2-aminophenyl)-4-[[[(Z)-2-cyano-1-(pyridin-4-ylamino)ethenyl]amino]methyl]benzamide Traditional Name: N-(2-aminophenyl)-4-[[[(Z)-2-cyano-1-(4-pyridylamino)vinyl]amino]methyl]benzamide Formula: C22H20N6O MolecularWeight: 384.4338

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CNC(=CC#N)NC3=CC=NC=C3

Isomeric SMILES

C1=CC=C(C(=C1)N)NC(=O)C2=CC=C(C=C2)CN/C(=C/C#N)/NC3=CC=NC=C3

InChI

InChI=1S/C22H20N6O/c23-12-9-21(27-18-10-13-25-14-11-18)26-15-16-5-7-17(8-6-16)22(29)28-20-4-2-1-3-19(20)24/h1-11,13-14,26H,15,24H2,(H,25,27)(H,28,29)/b21-9-