N1,N4-bis[6-(1,2,4-triazol-1-yl)pyridin-3-yl]benzene-1,4-dicarboxamide

Systemtic Name: N1,N4-bis[6-(1,2,4-triazol-1-yl)pyridin-3-yl]benzene-1,4-dicarboxamide Openeye Name: N1,N4-bis[6-(1,2,4-triazol-1-yl)-3-pyridyl]terephthalamide CAS Name: N1,N4-bis[6-(1,2,4-triazol-1-yl)-3-pyridinyl]benzene-1,4-dicarboxamide IUPAC Name: 1-N,4-N-bis[6-(1,2,4-triazol-1-yl)pyridin-3-yl]benzene-1,4-dicarboxamide Traditional Name: N,N'-bis[6-(1,2,4-triazol-1-yl)-3-pyridyl]terephthalamide Formula: C22H16N10O2 MolecularWeight: 452.42824

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NC2=CN=C(C=C2)N3C=NC=N3)C(=O)NC4=CN=C(C=C4)N5C=NC=N5

Isomeric SMILES

C1=CC(=CC=C1C(=O)NC2=CN=C(C=C2)N3C=NC=N3)C(=O)NC4=CN=C(C=C4)N5C=NC=N5

InChI

InChI=1S/C22H16N10O2/c33-21(29-17-5-7-19(25-9-17)31-13-23-11-27-31)15-1-2-16(4-3-15)22(34)30-18-6-8-20(26-10-18)32-14-24-12-28-32/h1-14H,(H,29,33)(H,30,34)