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

Systemtic Name: 4-[4-(cyclohexylmethyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)pteridin-2-amine Openeye Name: 4-[4-(cyclohexylmethyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)pteridin-2-amine CAS Name: 4-[4-(cyclohexylmethyl)-1-piperazinyl]-6-(3,4-dimethoxyphenyl)-2-pteridinamine IUPAC Name: 4-[4-(cyclohexylmethyl)piperazin-1-yl]-6-(3,4-dimethoxyphenyl)pteridin-2-amine Traditional Name: [4-[4-(cyclohexylmethyl)piperazino]-6-(3,4-dimethoxyphenyl)pteridin-2-yl]amine Formula: C25H33N7O2 MolecularWeight: 463.57522

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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)CC5CCCCC5)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CN=C3C(=N2)C(=NC(=N3)N)N4CCN(CC4)CC5CCCCC5)OC

InChI

InChI=1S/C25H33N7O2/c1-33-20-9-8-18(14-21(20)34-2)19-15-27-23-22(28-19)24(30-25(26)29-23)32-12-10-31(11-13-32)16-17-6-4-3-5-7-17/h8-9,14-15,17H,3-7,10-13,16H2,1-2H3,(H2,26,27,29,30)