N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]-9H-xanthene-9-carboxamide

Systemtic Name: N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]-9H-xanthene-9-carboxamide Openeye Name: N-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]-9H-xanthene-9-carboxamide CAS Name: N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]-9H-xanthene-9-carboxamide IUPAC Name: N-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)ethyl]-9H-xanthene-9-carboxamide Traditional Name: N-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]ethyl]-9H-xanthene-9-carboxamide Formula: C23H19N5O2 MolecularWeight: 397.42926

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCCC4=NC(=NN4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C(C3=CC=CC=C3O2)C(=O)NCCC4=NC(=NN4)C5=CC=NC=C5

InChI

InChI=1S/C23H19N5O2/c29-23(25-14-11-20-26-22(28-27-20)15-9-12-24-13-10-15)21-16-5-1-3-7-18(16)30-19-8-4-2-6-17(19)21/h1-10,12-13,21H,11,14H2,(H,25,29)(H,26,27,28)