ethyl 4-azanyl-2-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-butan-2-yl-amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate

Systemtic Name: ethyl 4-azanyl-2-[2-[[1,1-bis(oxidanylidene)thiolan-3-yl]-butan-2-yl-amino]-2-oxidanylidene-ethyl]sulfanyl-pyrimidine-5-carboxylate Openeye Name: ethyl 4-amino-2-[2-[(1,1-dioxothiolan-3-yl)-sec-butyl-amino]-2-oxo-ethyl]sulfanyl-pyrimidine-5-carboxylate CAS Name: 4-amino-2-[[2-[butan-2-yl-(1,1-dioxo-3-thiolanyl)amino]-2-oxoethyl]thio]-5-pyrimidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-2-[2-[butan-2-yl-(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl]sulfanylpyrimidine-5-carboxylate Traditional Name: 4-amino-2-[[2-[(1,1-diketothiolan-3-yl)-sec-butyl-amino]-2-keto-ethyl]thio]pyrimidine-5-carboxylic acid ethyl ester Formula: C17H26N4O5S2 MolecularWeight: 430.54214

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(C1CCS(=O)(=O)C1)C(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC

Isomeric SMILES

CCC(C)N(C1CCS(=O)(=O)C1)C(=O)CSC2=NC=C(C(=N2)N)C(=O)OCC

InChI

InChI=1S/C17H26N4O5S2/c1-4-11(3)21(12-6-7-28(24,25)10-12)14(22)9-27-17-19-8-13(15(18)20-17)16(23)26-5-2/h8,11-12H,4-7,9-10H2,1-3H3,(H2,18,19,20)