2-(6-azanylpyridin-3-yl)sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone

Systemtic Name: 2-(6-azanylpyridin-3-yl)sulfanyl-1-(4-ethanoylpiperazin-1-yl)ethanone Openeye Name: 1-(4-acetylpiperazin-1-yl)-2-[(6-amino-3-pyridyl)sulfanyl]ethanone CAS Name: 1-(4-acetyl-1-piperazinyl)-2-[(6-amino-3-pyridinyl)thio]ethanone IUPAC Name: 1-(4-acetylpiperazin-1-yl)-2-(6-aminopyridin-3-yl)sulfanylethanone Traditional Name: 1-(4-acetylpiperazino)-2-[(6-amino-3-pyridyl)thio]ethanone Formula: C13H18N4O2S MolecularWeight: 294.37262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CSC2=CN=C(C=C2)N

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)CSC2=CN=C(C=C2)N

InChI

InChI=1S/C13H18N4O2S/c1-10(18)16-4-6-17(7-5-16)13(19)9-20-11-2-3-12(14)15-8-11/h2-3,8H,4-7,9H2,1H3,(H2,14,15)