2-[(4-methylphenyl)methylsulfanyl]-N-(1H-pyrazol-4-yl)ethanamide

Systemtic Name: 2-[(4-methylphenyl)methylsulfanyl]-N-(1H-pyrazol-4-yl)ethanamide Openeye Name: 2-(p-tolylmethylsulfanyl)-N-(1H-pyrazol-4-yl)acetamide CAS Name: 2-[(4-methylphenyl)methylthio]-N-(1H-pyrazol-4-yl)acetamide IUPAC Name: 2-[(4-methylphenyl)methylsulfanyl]-N-(1H-pyrazol-4-yl)acetamide Traditional Name: 2-[(4-methylbenzyl)thio]-N-(1H-pyrazol-4-yl)acetamide Formula: C13H15N3OS MolecularWeight: 261.3427

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSCC(=O)NC2=CNN=C2

Isomeric SMILES

CC1=CC=C(C=C1)CSCC(=O)NC2=CNN=C2

InChI

InChI=1S/C13H15N3OS/c1-10-2-4-11(5-3-10)8-18-9-13(17)16-12-6-14-15-7-12/h2-7H,8-9H2,1H3,(H,14,15)(H,16,17)