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ethyl 4-[4-(hydroxymethyl)-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl]piperazine-1-carboxylate

ethyl 4-[4-(hydroxymethyl)-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl]piperazine-1-carboxylate

Systemtic Name:ethyl 4-[4-(hydroxymethyl)-5-nitro-6-thiomorpholin-4-yl-pyrimidin-2-yl]piperazine-1-carboxylate
Openeye Name:ethyl 4-[4-(hydroxymethyl)-5-nitro-6-thiomorpholino-pyrimidin-2-yl]piperazine-1-carboxylate
CAS Name:4-[4-(hydroxymethyl)-5-nitro-6-thiomorpholin-4-yl-2-pyrimidinyl]-1-piperazinecarboxylic acid ethyl ester
IUPAC Name:ethyl 4-[4-(hydroxymethyl)-5-nitro-6-thiomorpholin-4-ylpyrimidin-2-yl]piperazine-1-carboxylate
Traditional Name:4-(4-methylol-5-nitro-6-thiomorpholino-pyrimidin-2-yl)piperazine-1-carboxylic acid ethyl ester
Formula: C16H24N6O5S
MolecularWeight: 412.46396
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCN(CC1)C2=NC(=C(C(=N2)N3CCSCC3)[N+](=O)[O-])CO


Isomeric SMILES

CCOC(=O)N1CCN(CC1)C2=NC(=C(C(=N2)N3CCSCC3)[N+](=O)[O-])CO


InChI

InChI=1S/C16H24N6O5S/c1-2-27-16(24)21-5-3-20(4-6-21)15-17-12(11-23)13(22(25)26)14(18-15)19-7-9-28-10-8-19/h23H,2-11H2,1H3


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