N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide

Systemtic Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-2-pyridin-4-yl-quinoline-4-carboxamide Openeye Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-2-(4-pyridyl)quinoline-4-carboxamide CAS Name: N-[4-[(2-diethylaminoethylamino)-oxomethyl]phenyl]-2-pyridin-4-yl-4-quinolinecarboxamide IUPAC Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-2-pyridin-4-ylquinoline-4-carboxamide Traditional Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-2-(4-pyridyl)cinchoninamide Formula: C28H29N5O2 MolecularWeight: 467.56216

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=NC3=CC=CC=C32)C4=CC=NC=C4

InChI

InChI=1S/C28H29N5O2/c1-3-33(4-2)18-17-30-27(34)21-9-11-22(12-10-21)31-28(35)24-19-26(20-13-15-29-16-14-20)32-25-8-6-5-7-23(24)25/h5-16,19H,3-4,17-18H2,1-2H3,(H,30,34)(H,31,35)