(E)-3-[6-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-prop-2-enamide

Systemtic Name: (E)-3-[6-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-prop-2-enamide Openeye Name: (E)-3-[6-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-prop-2-enamide CAS Name: (E)-3-[6-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-2-propenamide IUPAC Name: (E)-3-[6-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenylprop-2-enamide Traditional Name: (E)-3-[6-(aminomethyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-acrylamide Formula: C17H16N4O MolecularWeight: 292.33514

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=CC2=CNC3=C2C=CC(=N3)CN)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)/C(=C\C2=CNC3=C2C=CC(=N3)CN)/C(=O)N

InChI

InChI=1S/C17H16N4O/c18-9-13-6-7-14-12(10-20-17(14)21-13)8-15(16(19)22)11-4-2-1-3-5-11/h1-8,10H,9,18H2,(H2,19,22)(H,20,21)/b15-8+