ethyl 2-[[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]carbothioylamino]ethanoate

Systemtic Name: ethyl 2-[[4-(4,6-dimethylpyrimidin-2-yl)piperazin-1-yl]carbothioylamino]ethanoate Openeye Name: ethyl 2-[[4-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carbothioyl]amino]acetate CAS Name: 2-[[[4-(4,6-dimethyl-2-pyrimidinyl)-1-piperazinyl]-sulfanylidenemethyl]amino]acetic acid ethyl ester IUPAC Name: ethyl 2-[[4-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carbothioyl]amino]acetate Traditional Name: 2-[[4-(4,6-dimethylpyrimidin-2-yl)piperazine-1-carbothioyl]amino]acetic acid ethyl ester Formula: C15H23N5O2S MolecularWeight: 337.44042

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CNC(=S)N1CCN(CC1)C2=NC(=CC(=N2)C)C

Isomeric SMILES

CCOC(=O)CNC(=S)N1CCN(CC1)C2=NC(=CC(=N2)C)C

InChI

InChI=1S/C15H23N5O2S/c1-4-22-13(21)10-16-15(23)20-7-5-19(6-8-20)14-17-11(2)9-12(3)18-14/h9H,4-8,10H2,1-3H3,(H,16,23)