(E)-N-[2-(4-azanyl-2-methyl-3-phenylmethoxy-quinolin-5-yl)-2-oxidanylidene-ethyl]-3-pyridin-4-yl-prop-2-enamide

Systemtic Name: (E)-N-[2-(4-azanyl-2-methyl-3-phenylmethoxy-quinolin-5-yl)-2-oxidanylidene-ethyl]-3-pyridin-4-yl-prop-2-enamide Openeye Name: (E)-N-[2-(4-amino-3-benzyloxy-2-methyl-5-quinolyl)-2-oxo-ethyl]-3-(4-pyridyl)prop-2-enamide CAS Name: (E)-N-[2-(4-amino-2-methyl-3-phenylmethoxy-5-quinolinyl)-2-oxoethyl]-3-pyridin-4-yl-2-propenamide IUPAC Name: (E)-N-[2-(4-amino-2-methyl-3-phenylmethoxyquinolin-5-yl)-2-oxoethyl]-3-pyridin-4-ylprop-2-enamide Traditional Name: (E)-N-[2-(4-amino-3-benzoxy-2-methyl-5-quinolyl)-2-keto-ethyl]-3-(4-pyridyl)acrylamide Formula: C27H24N4O3 MolecularWeight: 452.50446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC(=C2C(=C1OCC3=CC=CC=C3)N)C(=O)CNC(=O)C=CC4=CC=NC=C4

Isomeric SMILES

CC1=NC2=CC=CC(=C2C(=C1OCC3=CC=CC=C3)N)C(=O)CNC(=O)/C=C/C4=CC=NC=C4

InChI

InChI=1S/C27H24N4O3/c1-18-27(34-17-20-6-3-2-4-7-20)26(28)25-21(8-5-9-22(25)31-18)23(32)16-30-24(33)11-10-19-12-14-29-15-13-19/h2-15H,16-17H2,1H3,(H2,28,31)(H,30,33)/b11-10+