N-[3,5-bis(chloranyl)phenyl]-2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]ethanamide

Systemtic Name: N-[3,5-bis(chloranyl)phenyl]-2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]ethanamide Openeye Name: 2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]-N-(3,5-dichlorophenyl)acetamide CAS Name: 2-[(4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methylthio]-N-(3,5-dichlorophenyl)acetamide IUPAC Name: 2-[(4-cyano-5-methyl-2-phenylpyrazol-3-yl)methylsulfanyl]-N-(3,5-dichlorophenyl)acetamide Traditional Name: 2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylthio]-N-(3,5-dichlorophenyl)acetamide Formula: C20H16Cl2N4OS MolecularWeight: 431.33824

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C#N)CSCC(=O)NC2=CC(=CC(=C2)Cl)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C#N)CSCC(=O)NC2=CC(=CC(=C2)Cl)Cl)C3=CC=CC=C3

InChI

InChI=1S/C20H16Cl2N4OS/c1-13-18(10-23)19(26(25-13)17-5-3-2-4-6-17)11-28-12-20(27)24-16-8-14(21)7-15(22)9-16/h2-9H,11-12H2,1H3,(H,24,27)