N-[4-chloranyl-6-(4-diethoxyphosphorylbutoxyamino)pyrimidin-5-yl]methanamide

Systemtic Name: N-[4-chloranyl-6-(4-diethoxyphosphorylbutoxyamino)pyrimidin-5-yl]methanamide Openeye Name: N-[4-chloro-6-(4-diethoxyphosphorylbutoxyamino)pyrimidin-5-yl]formamide CAS Name: N-[4-chloro-6-(4-diethoxyphosphorylbutoxyamino)-5-pyrimidinyl]formamide IUPAC Name: N-[4-chloro-6-(4-diethoxyphosphorylbutoxyamino)pyrimidin-5-yl]formamide Traditional Name: N-[4-chloro-6-(4-diethoxyphosphorylbutoxyamino)pyrimidin-5-yl]formamide Formula: C13H22ClN4O5P MolecularWeight: 380.764341

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCCONC1=C(C(=NC=N1)Cl)NC=O)OCC

Isomeric SMILES

CCOP(=O)(CCCCONC1=C(C(=NC=N1)Cl)NC=O)OCC

InChI

InChI=1S/C13H22ClN4O5P/c1-3-22-24(20,23-4-2)8-6-5-7-21-18-13-11(17-10-19)12(14)15-9-16-13/h9-10H,3-8H2,1-2H3,(H,17,19)(H,15,16,18)