N1,N3-bis[3-(pyrimidin-2-ylamino)propyl]benzene-1,3-dicarboxamide

Systemtic Name: N1,N3-bis[3-(pyrimidin-2-ylamino)propyl]benzene-1,3-dicarboxamide Openeye Name: N1,N3-bis[3-(pyrimidin-2-ylamino)propyl]benzene-1,3-dicarboxamide CAS Name: N1,N3-bis[3-(2-pyrimidinylamino)propyl]benzene-1,3-dicarboxamide IUPAC Name: 1-N,3-N-bis[3-(pyrimidin-2-ylamino)propyl]benzene-1,3-dicarboxamide Traditional Name: N,N'-bis[3-(2-pyrimidylamino)propyl]isophthalamide Formula: C22H26N8O2 MolecularWeight: 434.49424

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NCCCNC2=NC=CC=N2)C(=O)NCCCNC3=NC=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NCCCNC2=NC=CC=N2)C(=O)NCCCNC3=NC=CC=N3

InChI

InChI=1S/C22H26N8O2/c31-19(23-8-2-10-25-21-27-12-4-13-28-21)17-6-1-7-18(16-17)20(32)24-9-3-11-26-22-29-14-5-15-30-22/h1,4-7,12-16H,2-3,8-11H2,(H,23,31)(H,24,32)(H,25,27,28)(H,26,29,30)