4-chloranyl-1,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide

Systemtic Name: 4-chloranyl-1,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide Openeye Name: 4-chloro-1,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide CAS Name: 4-chloro-N-(2-mercaptoethyl)-1,5-dimethyl-3-pyrazolecarboxamide IUPAC Name: 4-chloro-1,5-dimethyl-N-(2-sulfanylethyl)pyrazole-3-carboxamide Traditional Name: 4-chloro-N-(2-mercaptoethyl)-1,5-dimethyl-pyrazole-3-carboxamide Formula: C8H12ClN3OS MolecularWeight: 233.71838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C(=O)NCCS)Cl

Isomeric SMILES

CC1=C(C(=NN1C)C(=O)NCCS)Cl

InChI

InChI=1S/C8H12ClN3OS/c1-5-6(9)7(11-12(5)2)8(13)10-3-4-14/h14H,3-4H2,1-2H3,(H,10,13)