2-[4-[4-[(8-cyclopentyl-5-methyl-7-oxidanylidene-6H-pteridin-2-yl)amino]phenyl]piperazin-1-yl]ethanoic acid

Systemtic Name: 2-[4-[4-[(8-cyclopentyl-5-methyl-7-oxidanylidene-6H-pteridin-2-yl)amino]phenyl]piperazin-1-yl]ethanoic acid Openeye Name: 2-[4-[4-[(8-cyclopentyl-5-methyl-7-oxo-6H-pteridin-2-yl)amino]phenyl]piperazin-1-yl]acetic acid CAS Name: 2-[4-[4-[(8-cyclopentyl-5-methyl-7-oxo-6H-pteridin-2-yl)amino]phenyl]-1-piperazinyl]acetic acid IUPAC Name: 2-[4-[4-[(8-cyclopentyl-5-methyl-7-oxo-6H-pteridin-2-yl)amino]phenyl]piperazin-1-yl]acetic acid Traditional Name: 2-[4-[4-[(8-cyclopentyl-7-keto-5-methyl-6H-pteridin-2-yl)amino]phenyl]piperazino]acetic acid Formula: C24H31N7O3 MolecularWeight: 465.54804

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC(=O)N(C2=NC(=NC=C21)NC3=CC=C(C=C3)N4CCN(CC4)CC(=O)O)C5CCCC5

Isomeric SMILES

CN1CC(=O)N(C2=NC(=NC=C21)NC3=CC=C(C=C3)N4CCN(CC4)CC(=O)O)C5CCCC5

InChI

InChI=1S/C24H31N7O3/c1-28-15-21(32)31(19-4-2-3-5-19)23-20(28)14-25-24(27-23)26-17-6-8-18(9-7-17)30-12-10-29(11-13-30)16-22(33)34/h6-9,14,19H,2-5,10-13,15-16H2,1H3,(H,33,34)(H,25,26,27)