2-(5-bromanylpyridin-3-yl)-N-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)ethanamide

Systemtic Name: 2-(5-bromanylpyridin-3-yl)-N-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)ethanamide Openeye Name: 2-(5-bromo-3-pyridyl)-N-(4-cyano-5-methylsulfanyl-2-phenyl-pyrazol-3-yl)acetamide CAS Name: 2-(5-bromo-3-pyridinyl)-N-[4-cyano-5-(methylthio)-2-phenyl-3-pyrazolyl]acetamide IUPAC Name: 2-(5-bromopyridin-3-yl)-N-(4-cyano-5-methylsulfanyl-2-phenylpyrazol-3-yl)acetamide Traditional Name: 2-(5-bromo-3-pyridyl)-N-[4-cyano-5-(methylthio)-2-phenyl-pyrazol-3-yl]acetamide Formula: C18H14BrN5OS MolecularWeight: 428.30566

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN(C(=C1C#N)NC(=O)CC2=CC(=CN=C2)Br)C3=CC=CC=C3

Isomeric SMILES

CSC1=NN(C(=C1C#N)NC(=O)CC2=CC(=CN=C2)Br)C3=CC=CC=C3

InChI

InChI=1S/C18H14BrN5OS/c1-26-18-15(9-20)17(24(23-18)14-5-3-2-4-6-14)22-16(25)8-12-7-13(19)11-21-10-12/h2-7,10-11H,8H2,1H3,(H,22,25)