N-(2-azanyl-2-sulfanylidene-ethyl)-2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide

Systemtic Name: N-(2-azanyl-2-sulfanylidene-ethyl)-2-oxidanylidene-2-(4-pyrimidin-2-ylpiperazin-1-yl)ethanamide Openeye Name: N-(2-amino-2-thioxo-ethyl)-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide CAS Name: N-(2-amino-2-sulfanylideneethyl)-2-oxo-2-[4-(2-pyrimidinyl)-1-piperazinyl]acetamide IUPAC Name: N-(2-amino-2-sulfanylideneethyl)-2-oxo-2-(4-pyrimidin-2-ylpiperazin-1-yl)acetamide Traditional Name: N-(2-amino-2-thioxo-ethyl)-2-keto-2-[4-(2-pyrimidyl)piperazino]acetamide Formula: C12H16N6O2S MolecularWeight: 308.35944

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)C(=O)NCC(=S)N

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)C(=O)NCC(=S)N

InChI

InChI=1S/C12H16N6O2S/c13-9(21)8-16-10(19)11(20)17-4-6-18(7-5-17)12-14-2-1-3-15-12/h1-3H,4-8H2,(H2,13,21)(H,16,19)