N-(4-butoxyphenyl)-4-(6-piperazin-1-ylpyridin-3-yl)pyrimidin-2-amine

Systemtic Name: N-(4-butoxyphenyl)-4-(6-piperazin-1-ylpyridin-3-yl)pyrimidin-2-amine Openeye Name: N-(4-butoxyphenyl)-4-(6-piperazin-1-yl-3-pyridyl)pyrimidin-2-amine CAS Name: N-(4-butoxyphenyl)-4-[6-(1-piperazinyl)-3-pyridinyl]-2-pyrimidinamine IUPAC Name: N-(4-butoxyphenyl)-4-(6-piperazin-1-ylpyridin-3-yl)pyrimidin-2-amine Traditional Name: (4-butoxyphenyl)-[4-(6-piperazino-3-pyridyl)pyrimidin-2-yl]amine Formula: C23H28N6O MolecularWeight: 404.50802

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CN=C(C=C3)N4CCNCC4

Isomeric SMILES

CCCCOC1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CN=C(C=C3)N4CCNCC4

InChI

InChI=1S/C23H28N6O/c1-2-3-16-30-20-7-5-19(6-8-20)27-23-25-11-10-21(28-23)18-4-9-22(26-17-18)29-14-12-24-13-15-29/h4-11,17,24H,2-3,12-16H2,1H3,(H,25,27,28)