N-[3-(4-chloranylpyrazol-1-yl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide

Systemtic Name: N-[3-(4-chloranylpyrazol-1-yl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Openeye Name: N-[3-(4-chloropyrazol-1-yl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide CAS Name: N-[3-(4-chloro-1-pyrazolyl)propyl]-2-(1-ethyl-4-pyrazolyl)-4-quinolinecarboxamide IUPAC Name: N-[3-(4-chloropyrazol-1-yl)propyl]-2-(1-ethylpyrazol-4-yl)quinoline-4-carboxamide Traditional Name: N-[3-(4-chloropyrazol-1-yl)propyl]-2-(1-ethylpyrazol-4-yl)cinchoninamide Formula: C21H21ClN6O MolecularWeight: 408.88404

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4C=C(C=N4)Cl

Isomeric SMILES

CCN1C=C(C=N1)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCCN4C=C(C=N4)Cl

InChI

InChI=1S/C21H21ClN6O/c1-2-27-13-15(11-24-27)20-10-18(17-6-3-4-7-19(17)26-20)21(29)23-8-5-9-28-14-16(22)12-25-28/h3-4,6-7,10-14H,2,5,8-9H2,1H3,(H,23,29)