ethyl 5-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate

Systemtic Name: ethyl 5-[(6-azanyl-4-oxidanylidene-1H-pyrimidin-2-yl)sulfanylmethyl]-2-oxidanylidene-1,3-dihydroimidazole-4-carboxylate Openeye Name: ethyl 5-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]-2-oxo-1,3-dihydroimidazole-4-carboxylate CAS Name: 5-[[(6-amino-4-oxo-1H-pyrimidin-2-yl)thio]methyl]-2-oxo-1,3-dihydroimidazole-4-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(6-amino-4-oxo-1H-pyrimidin-2-yl)sulfanylmethyl]-2-oxo-1,3-dihydroimidazole-4-carboxylate Traditional Name: 5-[[(6-amino-4-keto-1H-pyrimidin-2-yl)thio]methyl]-2-keto-4-imidazoline-4-carboxylic acid ethyl ester Formula: C11H13N5O4S MolecularWeight: 311.31702

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=O)N1)CSC2=NC(=O)C=C(N2)N

Isomeric SMILES

CCOC(=O)C1=C(NC(=O)N1)CSC2=NC(=O)C=C(N2)N

InChI

InChI=1S/C11H13N5O4S/c1-2-20-9(18)8-5(13-10(19)16-8)4-21-11-14-6(12)3-7(17)15-11/h3H,2,4H2,1H3,(H2,13,16,19)(H3,12,14,15,17)