N-(2-propan-2-ylpyrazol-3-yl)-2-quinolin-2-ylsulfanyl-ethanamide

Systemtic Name: N-(2-propan-2-ylpyrazol-3-yl)-2-quinolin-2-ylsulfanyl-ethanamide Openeye Name: N-(2-isopropylpyrazol-3-yl)-2-(2-quinolylsulfanyl)acetamide CAS Name: N-(2-propan-2-yl-3-pyrazolyl)-2-(2-quinolinylthio)acetamide IUPAC Name: N-(2-propan-2-ylpyrazol-3-yl)-2-quinolin-2-ylsulfanylacetamide Traditional Name: N-(2-isopropylpyrazol-3-yl)-2-(2-quinolylthio)acetamide Formula: C17H18N4OS MolecularWeight: 326.41602

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)NC(=O)CSC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)N1C(=CC=N1)NC(=O)CSC2=NC3=CC=CC=C3C=C2

InChI

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