1-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-(9H-xanthen-9-yl)ethanone

Systemtic Name: 1-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-(9H-xanthen-9-yl)ethanone Openeye Name: 1-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]pyrrolidin-1-yl]-2-(9H-xanthen-9-yl)ethanone CAS Name: 1-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)-1-pyrrolidinyl]-2-(9H-xanthen-9-yl)ethanone IUPAC Name: 1-[2-(3-pyridin-4-yl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]-2-(9H-xanthen-9-yl)ethanone Traditional Name: 1-[2-[3-(4-pyridyl)-1H-1,2,4-triazol-5-yl]pyrrolidino]-2-(9H-xanthen-9-yl)ethanone Formula: C26H23N5O2 MolecularWeight: 437.49312

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24)C5=NC(=NN5)C6=CC=NC=C6

Isomeric SMILES

C1CC(N(C1)C(=O)CC2C3=CC=CC=C3OC4=CC=CC=C24)C5=NC(=NN5)C6=CC=NC=C6

InChI

InChI=1S/C26H23N5O2/c32-24(16-20-18-6-1-3-9-22(18)33-23-10-4-2-7-19(20)23)31-15-5-8-21(31)26-28-25(29-30-26)17-11-13-27-14-12-17/h1-4,6-7,9-14,20-21H,5,8,15-16H2,(H,28,29,30)