ethyl 4-azanyl-2-[2-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-[[(1R)-1,2-dimethylpropyl]amino]-2-oxo-ethoxy]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethoxy]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-[[(2R)-3-methylbutan-2-yl]amino]-2-oxoethoxy]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[2-[[(1R)-1,2-dimethylpropyl]amino]-2-keto-ethoxy]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C16H24N4O5S MolecularWeight: 384.45056

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCOC(=O)C1=CN=C(N=C1N)SCC(=O)OCC(=O)N[C@H](C)C(C)C

InChI

InChI=1S/C16H24N4O5S/c1-5-24-15(23)11-6-18-16(20-14(11)17)26-8-13(22)25-7-12(21)19-10(4)9(2)3/h6,9-10H,5,7-8H2,1-4H3,(H,19,21)(H2,17,18,20)/t10-/m1/s1