2-(4-ethanoylpiperazin-1-yl)pyridine-3-carbothioamide

Systemtic Name: 2-(4-ethanoylpiperazin-1-yl)pyridine-3-carbothioamide Openeye Name: 2-(4-acetylpiperazin-1-yl)pyridine-3-carbothioamide CAS Name: 2-(4-acetyl-1-piperazinyl)-3-pyridinecarbothioamide IUPAC Name: 2-(4-acetylpiperazin-1-yl)pyridine-3-carbothioamide Traditional Name: 2-(4-acetylpiperazino)thionicotinamide Formula: C12H16N4OS MolecularWeight: 264.34664

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C(=S)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=C(C=CC=N2)C(=S)N

InChI

InChI=1S/C12H16N4OS/c1-9(17)15-5-7-16(8-6-15)12-10(11(13)18)3-2-4-14-12/h2-4H,5-8H2,1H3,(H2,13,18)