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

Systemtic Name: ethyl 2-[4,6-bis(azanyl)pyrimidin-2-yl]sulfanylbutanoate Openeye Name: ethyl 2-(4,6-diaminopyrimidin-2-yl)sulfanylbutanoate CAS Name: 2-[(4,6-diamino-2-pyrimidinyl)thio]butanoic acid ethyl ester IUPAC Name: ethyl 2-(4,6-diaminopyrimidin-2-yl)sulfanylbutanoate Traditional Name: 2-[(4,6-diaminopyrimidin-2-yl)thio]butyric acid ethyl ester Formula: C10H16N4O2S MolecularWeight: 256.32464

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)OCC)SC1=NC(=CC(=N1)N)N

Isomeric SMILES

CCC(C(=O)OCC)SC1=NC(=CC(=N1)N)N

InChI

InChI=1S/C10H16N4O2S/c1-3-6(9(15)16-4-2)17-10-13-7(11)5-8(12)14-10/h5-6H,3-4H2,1-2H3,(H4,11,12,13,14)