1-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-amine

Systemtic Name: 1-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-amine Openeye Name: 1-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-amine CAS Name: 1-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)-6-pyrazolo[3,4-d]pyrimidinamine IUPAC Name: 1-(4-methoxyphenyl)-N-(3,4,5-trimethoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-amine Traditional Name: [1-(4-methoxyphenyl)pyrazolo[3,4-d]pyrimidin-6-yl]-(3,4,5-trimethoxyphenyl)amine Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C3=NC(=NC=C3C=N2)NC4=CC(=C(C(=C4)OC)OC)OC

Isomeric SMILES

COC1=CC=C(C=C1)N2C3=NC(=NC=C3C=N2)NC4=CC(=C(C(=C4)OC)OC)OC

InChI

InChI=1S/C21H21N5O4/c1-27-16-7-5-15(6-8-16)26-20-13(12-23-26)11-22-21(25-20)24-14-9-17(28-2)19(30-4)18(10-14)29-3/h5-12H,1-4H3,(H,22,24,25)