N4-(1-adamantyl)-6-(3,4,5-trimethoxyphenyl)pteridine-2,4-diamine

Systemtic Name: N4-(1-adamantyl)-6-(3,4,5-trimethoxyphenyl)pteridine-2,4-diamine Openeye Name: N4-(1-adamantyl)-6-(3,4,5-trimethoxyphenyl)pteridine-2,4-diamine CAS Name: N4-(1-adamantyl)-6-(3,4,5-trimethoxyphenyl)pteridine-2,4-diamine IUPAC Name: 4-N-(1-adamantyl)-6-(3,4,5-trimethoxyphenyl)pteridine-2,4-diamine Traditional Name: 1-adamantyl-[2-amino-6-(3,4,5-trimethoxyphenyl)pteridin-4-yl]amine Formula: C25H30N6O3 MolecularWeight: 462.5441

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C2=CN=C3C(=N2)C(=NC(=N3)N)NC45CC6CC(C4)CC(C6)C5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C2=CN=C3C(=N2)C(=NC(=N3)N)NC45CC6CC(C4)CC(C6)C5

InChI

InChI=1S/C25H30N6O3/c1-32-18-7-16(8-19(33-2)21(18)34-3)17-12-27-22-20(28-17)23(30-24(26)29-22)31-25-9-13-4-14(10-25)6-15(5-13)11-25/h7-8,12-15H,4-6,9-11H2,1-3H3,(H3,26,27,29,30,31)