N-(3-oxidanylpropyl)-3-[[4-[2-(3-oxidanylpropylamino)pyridin-4-yl]pyrimidin-2-yl]amino]benzamide

Systemtic Name: N-(3-oxidanylpropyl)-3-[[4-[2-(3-oxidanylpropylamino)pyridin-4-yl]pyrimidin-2-yl]amino]benzamide Openeye Name: N-(3-hydroxypropyl)-3-[[4-[2-(3-hydroxypropylamino)-4-pyridyl]pyrimidin-2-yl]amino]benzamide CAS Name: N-(3-hydroxypropyl)-3-[[4-[2-(3-hydroxypropylamino)-4-pyridinyl]-2-pyrimidinyl]amino]benzamide IUPAC Name: N-(3-hydroxypropyl)-3-[[4-[2-(3-hydroxypropylamino)pyridin-4-yl]pyrimidin-2-yl]amino]benzamide Traditional Name: N-(3-hydroxypropyl)-3-[[4-[2-(3-hydroxypropylamino)-4-pyridyl]pyrimidin-2-yl]amino]benzamide Formula: C22H26N6O3 MolecularWeight: 422.48024

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)NCCCO)C(=O)NCCCO

Isomeric SMILES

C1=CC(=CC(=C1)NC2=NC=CC(=N2)C3=CC(=NC=C3)NCCCO)C(=O)NCCCO

InChI

InChI=1S/C22H26N6O3/c29-12-2-8-23-20-15-16(6-10-24-20)19-7-11-26-22(28-19)27-18-5-1-4-17(14-18)21(31)25-9-3-13-30/h1,4-7,10-11,14-15,29-30H,2-3,8-9,12-13H2,(H,23,24)(H,25,31)(H,26,27,28)