ethyl 3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylpropanoate

Systemtic Name: ethyl 3-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylpropanoate Openeye Name: ethyl 3-(4,6-diaminopyrimidin-2-yl)sulfanylpropanoate CAS Name: 3-[(4,6-diamino-2-pyrimidinyl)thio]propanoic acid ethyl ester IUPAC Name: ethyl 3-(4,6-diaminopyrimidin-2-yl)sulfanylpropanoate Traditional Name: 3-[(4,6-diaminopyrimidin-2-yl)thio]propionic acid ethyl ester Formula: C9H14N4O2S MolecularWeight: 242.29806

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCSC1=NC(=CC(=N1)N)N

Isomeric SMILES

CCOC(=O)CCSC1=NC(=CC(=N1)N)N

InChI

InChI=1S/C9H14N4O2S/c1-2-15-8(14)3-4-16-9-12-6(10)5-7(11)13-9/h5H,2-4H2,1H3,(H4,10,11,12,13)