4-(4-ethanoylphenyl)-N-pyridin-2-yl-piperazine-1-carbothioamide

Systemtic Name: 4-(4-ethanoylphenyl)-N-pyridin-2-yl-piperazine-1-carbothioamide Openeye Name: 4-(4-acetylphenyl)-N-(2-pyridyl)piperazine-1-carbothioamide CAS Name: 4-(4-acetylphenyl)-N-(2-pyridinyl)-1-piperazinecarbothioamide IUPAC Name: 4-(4-acetylphenyl)-N-pyridin-2-ylpiperazine-1-carbothioamide Traditional Name: 4-(4-acetylphenyl)-N-(2-pyridyl)piperazine-1-carbothioamide Formula: C18H20N4OS MolecularWeight: 340.4426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=CC=N3

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N2CCN(CC2)C(=S)NC3=CC=CC=N3

InChI

InChI=1S/C18H20N4OS/c1-14(23)15-5-7-16(8-6-15)21-10-12-22(13-11-21)18(24)20-17-4-2-3-9-19-17/h2-9H,10-13H2,1H3,(H,19,20,24)