methyl 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate

Systemtic Name: methyl 2-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanyl]ethanoate Openeye Name: methyl 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate CAS Name: 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]acetic acid methyl ester IUPAC Name: methyl 2-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanyl]acetate Traditional Name: 2-[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]acetic acid methyl ester Formula: C7H9N3O3S MolecularWeight: 215.22966

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CSC1=NC(=O)C=C(N1)N

Isomeric SMILES

COC(=O)CSC1=NC(=O)C=C(N1)N

InChI

InChI=1S/C7H9N3O3S/c1-13-6(12)3-14-7-9-4(8)2-5(11)10-7/h2H,3H2,1H3,(H3,8,9,10,11)