2-chloranyl-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-methylsulfanyl-benzamide

Systemtic Name: 2-chloranyl-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-methylsulfanyl-benzamide Openeye Name: 2-chloro-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-methylsulfanyl-benzamide CAS Name: 2-chloro-N-[(1-ethyl-3,5-dimethyl-4-pyrazolyl)methyl]-5-(methylthio)benzamide IUPAC Name: 2-chloro-N-[(1-ethyl-3,5-dimethylpyrazol-4-yl)methyl]-5-methylsulfanylbenzamide Traditional Name: 2-chloro-N-[(1-ethyl-3,5-dimethyl-pyrazol-4-yl)methyl]-5-(methylthio)benzamide Formula: C16H20ClN3OS MolecularWeight: 337.8675

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)CNC(=O)C2=C(C=CC(=C2)SC)Cl)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)CNC(=O)C2=C(C=CC(=C2)SC)Cl)C

InChI

InChI=1S/C16H20ClN3OS/c1-5-20-11(3)14(10(2)19-20)9-18-16(21)13-8-12(22-4)6-7-15(13)17/h6-8H,5,9H2,1-4H3,(H,18,21)