3-[[2-[3,5-bis(azanyl)phenoxy]-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-ethoxy-benzenecarboximidamide

Systemtic Name: 3-[[2-[3,5-bis(azanyl)phenoxy]-6-oxidanylidene-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-ethoxy-benzenecarboximidamide Openeye Name: 3-[[2-(3,5-diaminophenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-ethoxy-benzamidine CAS Name: 3-[[2-(3,5-diaminophenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-ethoxybenzenecarboximidamide IUPAC Name: 3-[[2-(3,5-diaminophenoxy)-6-oxo-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-ethoxybenzenecarboximidamide Traditional Name: 3-[[2-(3,5-diaminophenoxy)-6-keto-7,8-dihydro-5H-pteridin-4-yl]oxy]-5-ethoxy-benzamidine Formula: C21H22N8O4 MolecularWeight: 450.45058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1)OC2=NC(=NC3=C2NC(=O)CN3)OC4=CC(=CC(=C4)N)N)C(=N)N

Isomeric SMILES

CCOC1=CC(=CC(=C1)OC2=NC(=NC3=C2NC(=O)CN3)OC4=CC(=CC(=C4)N)N)C(=N)N

InChI

InChI=1S/C21H22N8O4/c1-2-31-13-3-10(18(24)25)4-14(8-13)32-20-17-19(26-9-16(30)27-17)28-21(29-20)33-15-6-11(22)5-12(23)7-15/h3-8H,2,9,22-23H2,1H3,(H3,24,25)(H,27,30)(H,26,28,29)