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

Systemtic Name: (E)-3-[4-(cyclohexylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-prop-2-enamide Openeye Name: (E)-3-[4-(cyclohexylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-prop-2-enamide CAS Name: (E)-3-[4-(cyclohexylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-2-propenamide IUPAC Name: (E)-3-[4-(cyclohexylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenylprop-2-enamide Traditional Name: (E)-3-[4-(cyclohexylamino)-1H-pyrrolo[2,3-b]pyridin-3-yl]-2-phenyl-acrylamide Formula: C22H24N4O MolecularWeight: 360.45216

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC2=C3C(=CNC3=NC=C2)C=C(C4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1CCC(CC1)NC2=C3C(=CNC3=NC=C2)/C=C(\C4=CC=CC=C4)/C(=O)N

InChI

InChI=1S/C22H24N4O/c23-21(27)18(15-7-3-1-4-8-15)13-16-14-25-22-20(16)19(11-12-24-22)26-17-9-5-2-6-10-17/h1,3-4,7-8,11-14,17H,2,5-6,9-10H2,(H2,23,27)(H2,24,25,26)/b18-13+