(E)-3-[4-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-prop-2-enamide

Systemtic Name: (E)-3-[4-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-prop-2-enamide Openeye Name: (E)-3-[4-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-prop-2-enamide CAS Name: (E)-3-[4-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-2-propenamide IUPAC Name: (E)-3-[4-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyanoprop-2-enamide Traditional Name: (E)-3-[4-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-cyano-acrylamide Formula: C12H11N5O MolecularWeight: 241.24864

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C2C(=C1CN)C(=CN2)C=C(C#N)C(=O)N

Isomeric SMILES

C1=CN=C2C(=C1CN)C(=CN2)/C=C(\C#N)/C(=O)N

InChI

InChI=1S/C12H11N5O/c13-4-7-1-2-16-12-10(7)9(6-17-12)3-8(5-14)11(15)18/h1-3,6H,4,13H2,(H2,15,18)(H,16,17)/b8-3+