2-[[5-(5-bromanylfuran-2-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide

Systemtic Name: 2-[[5-(5-bromanylfuran-2-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-yl-ethanamide Openeye Name: 2-[[5-(5-bromo-2-furyl)-4-isopropyl-1,2,4-triazol-3-yl]sulfanyl]-N-(1-naphthyl)acetamide CAS Name: 2-[[5-(5-bromo-2-furanyl)-4-propan-2-yl-1,2,4-triazol-3-yl]thio]-N-(1-naphthalenyl)acetamide IUPAC Name: 2-[[5-(5-bromofuran-2-yl)-4-propan-2-yl-1,2,4-triazol-3-yl]sulfanyl]-N-naphthalen-1-ylacetamide Traditional Name: 2-[[5-(5-bromo-2-furyl)-4-isopropyl-1,2,4-triazol-3-yl]thio]-N-(1-naphthyl)acetamide Formula: C21H19BrN4O2S MolecularWeight: 471.37016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=NN=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC=C(O4)Br

Isomeric SMILES

CC(C)N1C(=NN=C1SCC(=O)NC2=CC=CC3=CC=CC=C32)C4=CC=C(O4)Br

InChI

InChI=1S/C21H19BrN4O2S/c1-13(2)26-20(17-10-11-18(22)28-17)24-25-21(26)29-12-19(27)23-16-9-5-7-14-6-3-4-8-15(14)16/h3-11,13H,12H2,1-2H3,(H,23,27)