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

Systemtic Name: 6-(3,4-dimethoxyphenyl)-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]pteridin-2-amine Openeye Name: 6-(3,4-dimethoxyphenyl)-4-[4-(p-tolylmethyl)piperazin-1-yl]pteridin-2-amine CAS Name: 6-(3,4-dimethoxyphenyl)-4-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-2-pteridinamine IUPAC Name: 6-(3,4-dimethoxyphenyl)-4-[4-[(4-methylphenyl)methyl]piperazin-1-yl]pteridin-2-amine Traditional Name: [6-(3,4-dimethoxyphenyl)-4-[4-(4-methylbenzyl)piperazino]pteridin-2-yl]amine Formula: C26H29N7O2 MolecularWeight: 471.55416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC(=NC4=NC=C(N=C43)C5=CC(=C(C=C5)OC)OC)N

Isomeric SMILES

CC1=CC=C(C=C1)CN2CCN(CC2)C3=NC(=NC4=NC=C(N=C43)C5=CC(=C(C=C5)OC)OC)N

InChI

InChI=1S/C26H29N7O2/c1-17-4-6-18(7-5-17)16-32-10-12-33(13-11-32)25-23-24(30-26(27)31-25)28-15-20(29-23)19-8-9-21(34-2)22(14-19)35-3/h4-9,14-15H,10-13,16H2,1-3H3,(H2,27,28,30,31)