N-dibenzofuran-2-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-dibenzofuran-2-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-dibenzofuran-2-yl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(2-dibenzofuranyl)-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-dibenzofuran-2-yl-2-[(5-pyridin-4-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-dibenzofuran-2-yl-2-[[5-(4-pyridyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H15N5O2S MolecularWeight: 401.4411

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)NC(=O)CSC4=NNC(=N4)C5=CC=NC=C5

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(O2)C=CC(=C3)NC(=O)CSC4=NNC(=N4)C5=CC=NC=C5

InChI

InChI=1S/C21H15N5O2S/c27-19(12-29-21-24-20(25-26-21)13-7-9-22-10-8-13)23-14-5-6-18-16(11-14)15-3-1-2-4-17(15)28-18/h1-11H,12H2,(H,23,27)(H,24,25,26)