2-(1,5-dimethylpyrazol-4-yl)-N-(2-sulfanylethyl)quinoline-4-carboxamide

Systemtic Name: 2-(1,5-dimethylpyrazol-4-yl)-N-(2-sulfanylethyl)quinoline-4-carboxamide Openeye Name: 2-(1,5-dimethylpyrazol-4-yl)-N-(2-sulfanylethyl)quinoline-4-carboxamide CAS Name: 2-(1,5-dimethyl-4-pyrazolyl)-N-(2-mercaptoethyl)-4-quinolinecarboxamide IUPAC Name: 2-(1,5-dimethylpyrazol-4-yl)-N-(2-sulfanylethyl)quinoline-4-carboxamide Traditional Name: 2-(1,5-dimethylpyrazol-4-yl)-N-(2-mercaptoethyl)cinchoninamide Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCS

Isomeric SMILES

CC1=C(C=NN1C)C2=NC3=CC=CC=C3C(=C2)C(=O)NCCS

InChI

InChI=1S/C17H18N4OS/c1-11-14(10-19-21(11)2)16-9-13(17(22)18-7-8-23)12-5-3-4-6-15(12)20-16/h3-6,9-10,23H,7-8H2,1-2H3,(H,18,22)