N-(3-pyrazol-1-ylpropyl)-2-thiophen-2-yl-quinoline-4-carboxamide

Systemtic Name: N-(3-pyrazol-1-ylpropyl)-2-thiophen-2-yl-quinoline-4-carboxamide Openeye Name: N-(3-pyrazol-1-ylpropyl)-2-(2-thienyl)quinoline-4-carboxamide CAS Name: N-[3-(1-pyrazolyl)propyl]-2-thiophen-2-yl-4-quinolinecarboxamide IUPAC Name: N-(3-pyrazol-1-ylpropyl)-2-thiophen-2-ylquinoline-4-carboxamide Traditional Name: N-(3-pyrazol-1-ylpropyl)-2-(2-thienyl)cinchoninamide Formula: C20H18N4OS MolecularWeight: 362.44812

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCCN4C=CC=N4

Isomeric SMILES

C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CS3)C(=O)NCCCN4C=CC=N4

InChI

InChI=1S/C20H18N4OS/c25-20(21-9-4-11-24-12-5-10-22-24)16-14-18(19-8-3-13-26-19)23-17-7-2-1-6-15(16)17/h1-3,5-8,10,12-14H,4,9,11H2,(H,21,25)