ethyl 4-azanyl-2-[2-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[2-[[(2S)-butan-2-yl]amino]-2-oxidanylidene-ethoxy]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[2-[[(1S)-1-methylpropyl]amino]-2-oxo-ethoxy]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[2-[[(2S)-butan-2-yl]amino]-2-oxoethoxy]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[2-[[(2S)-butan-2-yl]amino]-2-oxoethoxy]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-keto-2-[2-keto-2-[[(1S)-1-methylpropyl]amino]ethoxy]ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C15H22N4O5S MolecularWeight: 370.42398

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)NC(=O)COC(=O)CSC1=NC=C(C(=N1)N)C(=O)OCC

InChI

InChI=1S/C15H22N4O5S/c1-4-9(3)18-11(20)7-24-12(21)8-25-15-17-6-10(13(16)19-15)14(22)23-5-2/h6,9H,4-5,7-8H2,1-3H3,(H,18,20)(H2,16,17,19)/t9-/m0/s1