N-(3-carbamothioylphenyl)-2-pyrazol-1-yl-ethanamide

Systemtic Name: N-(3-carbamothioylphenyl)-2-pyrazol-1-yl-ethanamide Openeye Name: N-(3-carbamothioylphenyl)-2-pyrazol-1-yl-acetamide CAS Name: N-(3-carbamothioylphenyl)-2-(1-pyrazolyl)acetamide IUPAC Name: N-(3-carbamothioylphenyl)-2-pyrazol-1-ylacetamide Traditional Name: 2-pyrazol-1-yl-N-(3-thiocarbamoylphenyl)acetamide Formula: C12H12N4OS MolecularWeight: 260.31488

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CN2C=CC=N2)C(=S)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CN2C=CC=N2)C(=S)N

InChI

InChI=1S/C12H12N4OS/c13-12(18)9-3-1-4-10(7-9)15-11(17)8-16-6-2-5-14-16/h1-7H,8H2,(H2,13,18)(H,15,17)