N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide

Systemtic Name: N-(1,5-dimethyl-3-oxidanylidene-2-phenyl-pyrazol-4-yl)-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Openeye Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-(5-ethyl-2-thienyl)quinoline-4-carboxamide CAS Name: N-(1,5-dimethyl-3-oxo-2-phenyl-4-pyrazolyl)-2-(5-ethyl-2-thiophenyl)-4-quinolinecarboxamide IUPAC Name: N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(5-ethylthiophen-2-yl)quinoline-4-carboxamide Traditional Name: 2-(5-ethyl-2-thienyl)-N-(3-keto-1,5-dimethyl-2-phenyl-3-pyrazolin-4-yl)cinchoninamide Formula: C27H24N4O2S MolecularWeight: 468.57006

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C

Isomeric SMILES

CCC1=CC=C(S1)C2=NC3=CC=CC=C3C(=C2)C(=O)NC4=C(N(N(C4=O)C5=CC=CC=C5)C)C

InChI

InChI=1S/C27H24N4O2S/c1-4-19-14-15-24(34-19)23-16-21(20-12-8-9-13-22(20)28-23)26(32)29-25-17(2)30(3)31(27(25)33)18-10-6-5-7-11-18/h5-16H,4H2,1-3H3,(H,29,32)