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

Systemtic Name: 2-(6-azanylpyridin-3-yl)sulfanyl-1-(4-methylpiperazin-1-yl)ethanone Openeye Name: 2-[(6-amino-3-pyridyl)sulfanyl]-1-(4-methylpiperazin-1-yl)ethanone CAS Name: 2-[(6-amino-3-pyridinyl)thio]-1-(4-methyl-1-piperazinyl)ethanone IUPAC Name: 2-(6-aminopyridin-3-yl)sulfanyl-1-(4-methylpiperazin-1-yl)ethanone Traditional Name: 2-[(6-amino-3-pyridyl)thio]-1-(4-methylpiperazino)ethanone Formula: C12H18N4OS MolecularWeight: 266.36252

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)C(=O)CSC2=CN=C(C=C2)N

Isomeric SMILES

CN1CCN(CC1)C(=O)CSC2=CN=C(C=C2)N

InChI

InChI=1S/C12H18N4OS/c1-15-4-6-16(7-5-15)12(17)9-18-10-2-3-11(13)14-8-10/h2-3,8H,4-7,9H2,1H3,(H2,13,14)