ethyl 4-azanyl-2-[(4-azanyl-5-ethoxycarbonyl-pyrimidin-2-yl)disulfanyl]pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[(4-azanyl-5-ethoxycarbonyl-pyrimidin-2-yl)disulfanyl]pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[(4-amino-5-ethoxycarbonyl-pyrimidin-2-yl)disulfanyl]pyrimidine-5-carboxylate CAS Name: 4-amino-2-[(4-amino-5-ethoxycarbonyl-2-pyrimidinyl)disulfanyl]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[(4-amino-5-ethoxycarbonylpyrimidin-2-yl)disulfanyl]pyrimidine-5-carboxylate Traditional Name: 4-amino-2-[(4-amino-5-carbethoxy-pyrimidin-2-yl)disulfanyl]pyrimidine-5-carboxylic acid ethyl ester Formula: C14H16N6O4S2 MolecularWeight: 396.44464

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(N=C1N)SSC2=NC=C(C(=N2)N)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SSC2=NC=C(C(=N2)N)C(=O)OCC

InChI

InChI=1S/C14H16N6O4S2/c1-3-23-11(21)7-5-17-13(19-9(7)15)25-26-14-18-6-8(10(16)20-14)12(22)24-4-2/h5-6H,3-4H2,1-2H3,(H2,15,17,19)(H2,16,18,20)