methyl 2-[[6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate

Systemtic Name: methyl 2-[[6-(2-methoxy-2-oxidanylidene-ethyl)sulfanyl-5-nitro-pyrimidin-4-yl]-methyl-amino]ethanoate Openeye Name: methyl 2-[[6-(2-methoxy-2-oxo-ethyl)sulfanyl-5-nitro-pyrimidin-4-yl]-methyl-amino]acetate CAS Name: 2-[[6-[(2-methoxy-2-oxoethyl)thio]-5-nitro-4-pyrimidinyl]-methylamino]acetic acid methyl ester IUPAC Name: methyl 2-[[6-(2-methoxy-2-oxoethyl)sulfanyl-5-nitropyrimidin-4-yl]-methylamino]acetate Traditional Name: 2-[[6-[(2-keto-2-methoxy-ethyl)thio]-5-nitro-pyrimidin-4-yl]-methyl-amino]acetic acid methyl ester Formula: C11H14N4O6S MolecularWeight: 330.31706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)OC)C1=C(C(=NC=N1)SCC(=O)OC)[N+](=O)[O-]

Isomeric SMILES

CN(CC(=O)OC)C1=C(C(=NC=N1)SCC(=O)OC)[N+](=O)[O-]

InChI

InChI=1S/C11H14N4O6S/c1-14(4-7(16)20-2)10-9(15(18)19)11(13-6-12-10)22-5-8(17)21-3/h6H,4-5H2,1-3H3