4-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine

Systemtic Name: 4-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine Openeye Name: 4-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine CAS Name: 4-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)-2-pyrimidinamine IUPAC Name: 4-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]-N-(3,4,5-trimethoxyphenyl)pyrimidin-2-amine Traditional Name: [4-[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]pyrimidin-2-yl]-(3,4,5-trimethoxyphenyl)amine Formula: C23H21N5O5 MolecularWeight: 447.44334

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)C3=C(NN=C3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)NC2=NC=CC(=N2)C3=C(NN=C3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C23H21N5O5/c1-29-19-9-14(10-20(30-2)22(19)31-3)26-23-24-7-6-16(27-23)15-11-25-28-21(15)13-4-5-17-18(8-13)33-12-32-17/h4-11H,12H2,1-3H3,(H,25,28)(H,24,26,27)