N-butyl-2-[6-diethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]ethanamide

Systemtic Name: N-butyl-2-[6-diethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]ethanamide Openeye Name: N-butyl-2-[6-diethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]acetamide CAS Name: N-butyl-2-[6-diethoxyphosphinothioyloxy-2-(ethylamino)-4-pyrimidinyl]acetamide IUPAC Name: N-butyl-2-[6-diethoxyphosphinothioyloxy-2-(ethylamino)pyrimidin-4-yl]acetamide Traditional Name: N-butyl-2-[6-diethoxythiophosphoryloxy-2-(ethylamino)pyrimidin-4-yl]acetamide Formula: C16H29N4O4PS MolecularWeight: 404.464621

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)CC1=CC(=NC(=N1)NCC)OP(=S)(OCC)OCC

Isomeric SMILES

CCCCNC(=O)CC1=CC(=NC(=N1)NCC)OP(=S)(OCC)OCC

InChI

InChI=1S/C16H29N4O4PS/c1-5-9-10-18-14(21)11-13-12-15(20-16(19-13)17-6-2)24-25(26,22-7-3)23-8-4/h12H,5-11H2,1-4H3,(H,18,21)(H,17,19,20)