2-(3-azanylpyridin-2-yl)sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone

Systemtic Name: 2-(3-azanylpyridin-2-yl)sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone Openeye Name: 2-[(3-amino-2-pyridyl)sulfanyl]-1-(4-methylsulfonylpiperazin-1-yl)ethanone CAS Name: 2-[(3-amino-2-pyridinyl)thio]-1-(4-methylsulfonyl-1-piperazinyl)ethanone IUPAC Name: 2-(3-aminopyridin-2-yl)sulfanyl-1-(4-methylsulfonylpiperazin-1-yl)ethanone Traditional Name: 2-[(3-amino-2-pyridyl)thio]-1-(4-mesylpiperazino)ethanone Formula: C12H18N4O3S2 MolecularWeight: 330.42632

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)N1CCN(CC1)C(=O)CSC2=C(C=CC=N2)N

Isomeric SMILES

CS(=O)(=O)N1CCN(CC1)C(=O)CSC2=C(C=CC=N2)N

InChI

InChI=1S/C12H18N4O3S2/c1-21(18,19)16-7-5-15(6-8-16)11(17)9-20-12-10(13)3-2-4-14-12/h2-4H,5-9,13H2,1H3