1-(2,2-dimethylpropyl)-3-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidine-7-carbonitrile

Systemtic Name: 1-(2,2-dimethylpropyl)-3-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4H-pyrimido[4,5-d]pyrimidine-7-carbonitrile Openeye Name: 1-(2,2-dimethylpropyl)-3-[(4-methoxyphenyl)methyl]-2-oxo-4H-pyrimido[4,5-d]pyrimidine-7-carbonitrile CAS Name: 1-(2,2-dimethylpropyl)-3-[(4-methoxyphenyl)methyl]-2-oxo-4H-pyrimido[4,5-d]pyrimidine-7-carbonitrile IUPAC Name: 1-(2,2-dimethylpropyl)-3-[(4-methoxyphenyl)methyl]-2-oxo-4H-pyrimido[4,5-d]pyrimidine-7-carbonitrile Traditional Name: 2-keto-1-neopentyl-3-p-anisyl-4H-pyrimido[4,5-d]pyrimidine-7-carbonitrile Formula: C20H23N5O2 MolecularWeight: 365.42892

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CN1C2=NC(=NC=C2CN(C1=O)CC3=CC=C(C=C3)OC)C#N

Isomeric SMILES

CC(C)(C)CN1C2=NC(=NC=C2CN(C1=O)CC3=CC=C(C=C3)OC)C#N

InChI

InChI=1S/C20H23N5O2/c1-20(2,3)13-25-18-15(10-22-17(9-21)23-18)12-24(19(25)26)11-14-5-7-16(27-4)8-6-14/h5-8,10H,11-13H2,1-4H3