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

Systemtic Name: N-(3-chlorophenyl)-2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]ethanamide Openeye Name: N-(3-chlorophenyl)-2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylsulfanyl]acetamide CAS Name: N-(3-chlorophenyl)-2-[(4-cyano-5-methyl-2-phenyl-3-pyrazolyl)methylthio]acetamide IUPAC Name: N-(3-chlorophenyl)-2-[(4-cyano-5-methyl-2-phenylpyrazol-3-yl)methylsulfanyl]acetamide Traditional Name: N-(3-chlorophenyl)-2-[(4-cyano-5-methyl-2-phenyl-pyrazol-3-yl)methylthio]acetamide Formula: C20H17ClN4OS MolecularWeight: 396.89318

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H17ClN4OS/c1-14-18(11-22)19(25(24-14)17-8-3-2-4-9-17)12-27-13-20(26)23-16-7-5-6-15(21)10-16/h2-10H,12-13H2,1H3,(H,23,26)