N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-phenylsulfanyl-ethanamide

Systemtic Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-phenylsulfanyl-ethanamide Openeye Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-phenylsulfanyl-acetamide CAS Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(phenylthio)acetamide IUPAC Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-phenylsulfanylacetamide Traditional Name: N-(3,5-dimethyl-1H-pyrazol-4-yl)-2-(phenylthio)acetamide Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1)C)NC(=O)CSC2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=NN1)C)NC(=O)CSC2=CC=CC=C2

InChI

InChI=1S/C13H15N3OS/c1-9-13(10(2)16-15-9)14-12(17)8-18-11-6-4-3-5-7-11/h3-7H,8H2,1-2H3,(H,14,17)(H,15,16)