N-[(3,4-diethoxyphenyl)methyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[(3,4-diethoxyphenyl)methyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[(3,4-diethoxyphenyl)methyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[(3,4-diethoxyphenyl)methyl]-2-(1-ethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[(3,4-diethoxyphenyl)methyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-(3,4-diethoxybenzyl)-2-(1-ethylpyrazol-4-yl)cinchoninamide Formula: C26H28N4O3 MolecularWeight: 444.52552

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=C(C=C4)OCC)OCC

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCC4=CC(=C(C=C4)OCC)OCC

InChI

InChI=1S/C26H28N4O3/c1-4-30-17-19(16-28-30)23-14-21(20-9-7-8-10-22(20)29-23)26(31)27-15-18-11-12-24(32-5-2)25(13-18)33-6-3/h7-14,16-17H,4-6,15H2,1-3H3,(H,27,31)