6-(3,4-dimethoxyphenyl)-4-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]pteridin-2-amine

Systemtic Name: 6-(3,4-dimethoxyphenyl)-4-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]pteridin-2-amine Openeye Name: 6-(3,4-dimethoxyphenyl)-4-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]pteridin-2-amine CAS Name: 6-(3,4-dimethoxyphenyl)-4-[4-[2-(1-imidazolyl)ethyl]-1-piperazinyl]-2-pteridinamine IUPAC Name: 6-(3,4-dimethoxyphenyl)-4-[4-(2-imidazol-1-ylethyl)piperazin-1-yl]pteridin-2-amine Traditional Name: [6-(3,4-dimethoxyphenyl)-4-[4-(2-imidazol-1-ylethyl)piperazino]pteridin-2-yl]amine Formula: C23H27N9O2 MolecularWeight: 461.51958

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CN=C3C(=N2)C(=NC(=N3)N)N4CCN(CC4)CCN5C=CN=C5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=C3C(=N2)C(=NC(=N3)N)N4CCN(CC4)CCN5C=CN=C5)OC

InChI

InChI=1S/C23H27N9O2/c1-33-18-4-3-16(13-19(18)34-2)17-14-26-21-20(27-17)22(29-23(24)28-21)32-11-9-30(10-12-32)7-8-31-6-5-25-15-31/h3-6,13-15H,7-12H2,1-2H3,(H2,24,26,28,29)