N-(5-bromanylpyridin-2-yl)-2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-(5-bromanylpyridin-2-yl)-2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-(5-bromo-2-pyridyl)-2-[[4-cyclopropyl-5-(2-furyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(5-bromo-2-pyridinyl)-2-[[4-cyclopropyl-5-(2-furanyl)-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-(5-bromopyridin-2-yl)-2-[[4-cyclopropyl-5-(furan-2-yl)-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-(5-bromo-2-pyridyl)-2-[[4-cyclopropyl-5-(2-furyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H14BrN5O2S MolecularWeight: 420.28366

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=C2SCC(=O)NC3=NC=C(C=C3)Br)C4=CC=CO4

Isomeric SMILES

C1CC1N2C(=NN=C2SCC(=O)NC3=NC=C(C=C3)Br)C4=CC=CO4

InChI

InChI=1S/C16H14BrN5O2S/c17-10-3-6-13(18-8-10)19-14(23)9-25-16-21-20-15(12-2-1-7-24-12)22(16)11-4-5-11/h1-3,6-8,11H,4-5,9H2,(H,18,19,23)