dimethyl 2-[[5-phenyl-3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]amino]pentanedioate

Systemtic Name: dimethyl 2-[[5-phenyl-3-(phenylmethyl)-[1,2,3]triazolo[4,5-d]pyrimidin-7-yl]amino]pentanedioate Openeye Name: dimethyl 2-[(3-benzyl-5-phenyl-triazolo[4,5-d]pyrimidin-7-yl)amino]pentanedioate CAS Name: 2-[[5-phenyl-3-(phenylmethyl)-7-triazolo[4,5-d]pyrimidinyl]amino]pentanedioic acid dimethyl ester IUPAC Name: dimethyl 2-[(3-benzyl-5-phenyltriazolo[4,5-d]pyrimidin-7-yl)amino]pentanedioate Traditional Name: 2-[(3-benzyl-5-phenyl-triazolo[4,5-d]pyrimidin-7-yl)amino]glutaric acid dimethyl ester Formula: C24H24N6O4 MolecularWeight: 460.48516

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCC(C(=O)OC)NC1=NC(=NC2=C1N=NN2CC3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)CCC(C(=O)OC)NC1=NC(=NC2=C1N=NN2CC3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C24H24N6O4/c1-33-19(31)14-13-18(24(32)34-2)25-22-20-23(27-21(26-22)17-11-7-4-8-12-17)30(29-28-20)15-16-9-5-3-6-10-16/h3-12,18H,13-15H2,1-2H3,(H,25,26,27)