2-quinolin-2-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide

Systemtic Name: 2-quinolin-2-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Openeye Name: 2-(2-quinolylsulfanyl)-N-(1,3,5-trimethylpyrazol-4-yl)propanamide CAS Name: 2-(2-quinolinylthio)-N-(1,3,5-trimethyl-4-pyrazolyl)propanamide IUPAC Name: 2-quinolin-2-ylsulfanyl-N-(1,3,5-trimethylpyrazol-4-yl)propanamide Traditional Name: 2-(2-quinolylthio)-N-(1,3,5-trimethylpyrazol-4-yl)propionamide Formula: C18H20N4OS MolecularWeight: 340.4426

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)NC(=O)C(C)SC2=NC3=CC=CC=C3C=C2

Isomeric SMILES

CC1=C(C(=NN1C)C)NC(=O)C(C)SC2=NC3=CC=CC=C3C=C2

InChI

InChI=1S/C18H20N4OS/c1-11-17(12(2)22(4)21-11)20-18(23)13(3)24-16-10-9-14-7-5-6-8-15(14)19-16/h5-10,13H,1-4H3,(H,20,23)