N-[5-oxidanylidene-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]ethanamide

Systemtic Name: N-[5-oxidanylidene-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]ethanamide Openeye Name: N-[5-oxo-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]acetamide CAS Name: N-[5-oxo-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]acetamide IUPAC Name: N-[5-oxo-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]acetamide Traditional Name: N-[5-keto-7-(2-propoxyphenyl)-8H-pyrimido[4,5-d]pyrimidin-2-yl]acetamide Formula: C17H17N5O3 MolecularWeight: 339.34858

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC=C1C2=NC(=O)C3=CN=C(N=C3N2)NC(=O)C

Isomeric SMILES

CCCOC1=CC=CC=C1C2=NC(=O)C3=CN=C(N=C3N2)NC(=O)C

InChI

InChI=1S/C17H17N5O3/c1-3-8-25-13-7-5-4-6-11(13)14-20-15-12(16(24)21-14)9-18-17(22-15)19-10(2)23/h4-7,9H,3,8H2,1-2H3,(H2,18,19,20,21,22,23,24)