1-[4-[(4-azanylpteridin-2-yl)methoxy]-2-oxidanyl-3-propyl-phenyl]ethanone

Systemtic Name: 1-[4-[(4-azanylpteridin-2-yl)methoxy]-2-oxidanyl-3-propyl-phenyl]ethanone Openeye Name: 1-[4-[(4-aminopteridin-2-yl)methoxy]-2-hydroxy-3-propyl-phenyl]ethanone CAS Name: 1-[4-[(4-amino-2-pteridinyl)methoxy]-2-hydroxy-3-propylphenyl]ethanone IUPAC Name: 1-[4-[(4-aminopteridin-2-yl)methoxy]-2-hydroxy-3-propylphenyl]ethanone Traditional Name: 1-[4-[(4-aminopteridin-2-yl)methoxy]-2-hydroxy-3-propyl-phenyl]ethanone Formula: C18H19N5O3 MolecularWeight: 353.37516

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=NC3=NC=CN=C3C(=N2)N

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=NC3=NC=CN=C3C(=N2)N

InChI

InChI=1S/C18H19N5O3/c1-3-4-12-13(6-5-11(10(2)24)16(12)25)26-9-14-22-17(19)15-18(23-14)21-8-7-20-15/h5-8,25H,3-4,9H2,1-2H3,(H2,19,21,22,23)