N-[6-[(4-diethoxyphosphorylphenyl)iminomethyl]-4-oxidanylidene-1H-pteridin-2-yl]ethanamide

Systemtic Name: N-[6-[(4-diethoxyphosphorylphenyl)iminomethyl]-4-oxidanylidene-1H-pteridin-2-yl]ethanamide Openeye Name: N-[6-[(4-diethoxyphosphorylphenyl)iminomethyl]-4-oxo-1H-pteridin-2-yl]acetamide CAS Name: N-[6-[(4-diethoxyphosphorylphenyl)iminomethyl]-4-oxo-1H-pteridin-2-yl]acetamide IUPAC Name: N-[6-[(4-diethoxyphosphorylphenyl)iminomethyl]-4-oxo-1H-pteridin-2-yl]acetamide Traditional Name: N-[6-[(4-diethoxyphosphorylphenyl)iminomethyl]-4-keto-1H-pteridin-2-yl]acetamide Formula: C19H21N6O5P MolecularWeight: 444.381001

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C1=CC=C(C=C1)N=CC2=CN=C3C(=N2)C(=O)N=C(N3)NC(=O)C)OCC

Isomeric SMILES

CCOP(=O)(C1=CC=C(C=C1)N=CC2=CN=C3C(=N2)C(=O)N=C(N3)NC(=O)C)OCC

InChI

InChI=1S/C19H21N6O5P/c1-4-29-31(28,30-5-2)15-8-6-13(7-9-15)20-10-14-11-21-17-16(23-14)18(27)25-19(24-17)22-12(3)26/h6-11H,4-5H2,1-3H3,(H2,21,22,24,25,26,27)