2-(1,3-dimethyl-6-oxidanylidene-2H-purin-7-yl)ethyl 2-methyl-2-[4-methyl-1-(phenylmethyl)pyrazol-3-yl]oxy-propanoate

Systemtic Name: 2-(1,3-dimethyl-6-oxidanylidene-2H-purin-7-yl)ethyl 2-methyl-2-[4-methyl-1-(phenylmethyl)pyrazol-3-yl]oxy-propanoate Openeye Name: 2-(1,3-dimethyl-6-oxo-2H-purin-7-yl)ethyl 2-(1-benzyl-4-methyl-pyrazol-3-yl)oxy-2-methyl-propanoate CAS Name: 2-methyl-2-[[4-methyl-1-(phenylmethyl)-3-pyrazolyl]oxy]propanoic acid 2-(1,3-dimethyl-6-oxo-2H-purin-7-yl)ethyl ester IUPAC Name: 2-(1,3-dimethyl-6-oxo-2H-purin-7-yl)ethyl 2-(1-benzyl-4-methylpyrazol-3-yl)oxy-2-methylpropanoate Traditional Name: 2-(1-benzyl-4-methyl-pyrazol-3-yl)oxy-2-methyl-propionic acid 2-(6-keto-1,3-dimethyl-2H-purin-7-yl)ethyl ester Formula: C24H30N6O4 MolecularWeight: 466.5328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1OC(C)(C)C(=O)OCCN2C=NC3=C2C(=O)N(CN3C)C)CC4=CC=CC=C4

Isomeric SMILES

CC1=CN(N=C1OC(C)(C)C(=O)OCCN2C=NC3=C2C(=O)N(CN3C)C)CC4=CC=CC=C4

InChI

InChI=1S/C24H30N6O4/c1-17-13-30(14-18-9-7-6-8-10-18)26-21(17)34-24(2,3)23(32)33-12-11-29-15-25-20-19(29)22(31)28(5)16-27(20)4/h6-10,13,15H,11-12,14,16H2,1-5H3