2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide

Systemtic Name: 2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-ethanamide Openeye Name: 2-[[5-(2-furyl)-4-isobutyl-1,2,4-triazol-3-yl]sulfanyl]-2-phenyl-acetamide CAS Name: 2-[[5-(2-furanyl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]thio]-2-phenylacetamide IUPAC Name: 2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]-2-phenylacetamide Traditional Name: 2-[[5-(2-furyl)-4-isobutyl-1,2,4-triazol-3-yl]thio]-2-phenyl-acetamide Formula: C18H20N4O2S MolecularWeight: 356.442

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N)C3=CC=CO3

Isomeric SMILES

CC(C)CN1C(=NN=C1SC(C2=CC=CC=C2)C(=O)N)C3=CC=CO3

InChI

InChI=1S/C18H20N4O2S/c1-12(2)11-22-17(14-9-6-10-24-14)20-21-18(22)25-15(16(19)23)13-7-4-3-5-8-13/h3-10,12,15H,11H2,1-2H3,(H2,19,23)