N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-sulfanyl-ethanamide

Systemtic Name: N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-sulfanyl-ethanamide Openeye Name: N-[5-(p-tolyl)-1H-pyrazol-3-yl]-2-sulfanyl-acetamide CAS Name: 2-mercapto-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]acetamide IUPAC Name: N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-2-sulfanylacetamide Traditional Name: 2-mercapto-N-[5-(p-tolyl)-1H-pyrazol-3-yl]acetamide Formula: C12H13N3OS MolecularWeight: 247.31612

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=CC(=NN2)NC(=O)CS

Isomeric SMILES

CC1=CC=C(C=C1)C2=CC(=NN2)NC(=O)CS

InChI

InChI=1S/C12H13N3OS/c1-8-2-4-9(5-3-8)10-6-11(15-14-10)13-12(16)7-17/h2-6,17H,7H2,1H3,(H2,13,14,15,16)