6-chloranyl-2-(5-ethylthiophen-2-yl)-N-[1-(phenylmethyl)pyrazol-4-yl]quinoline-4-carboxamide

Systemtic Name: 6-chloranyl-2-(5-ethylthiophen-2-yl)-N-[1-(phenylmethyl)pyrazol-4-yl]quinoline-4-carboxamide Openeye Name: N-(1-benzylpyrazol-4-yl)-6-chloro-2-(5-ethyl-2-thienyl)quinoline-4-carboxamide CAS Name: 6-chloro-2-(5-ethyl-2-thiophenyl)-N-[1-(phenylmethyl)-4-pyrazolyl]-4-quinolinecarboxamide IUPAC Name: N-(1-benzylpyrazol-4-yl)-6-chloro-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: N-(1-benzylpyrazol-4-yl)-6-chloro-2-(5-ethyl-2-thienyl)cinchoninamide Formula: C26H21ClN4OS MolecularWeight: 472.98914

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NC4=CN(N=C4)CC5=CC=CC=C5

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=C(C=C(C=C3)Cl)C(=C2)C(=O)NC4=CN(N=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H21ClN4OS/c1-2-20-9-11-25(33-20)24-13-22(21-12-18(27)8-10-23(21)30-24)26(32)29-19-14-28-31(16-19)15-17-6-4-3-5-7-17/h3-14,16H,2,15H2,1H3,(H,29,32)