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

Systemtic Name: 2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-ethanamide Openeye Name: 2-[[5-(2-furyl)-4-isobutyl-1,2,4-triazol-3-yl]sulfanyl]-N-phenethyl-acetamide CAS Name: 2-[[5-(2-furanyl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]thio]-N-phenethylacetamide IUPAC Name: 2-[[5-(furan-2-yl)-4-(2-methylpropyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenethylacetamide Traditional Name: 2-[[5-(2-furyl)-4-isobutyl-1,2,4-triazol-3-yl]thio]-N-phenethyl-acetamide Formula: C20H24N4O2S MolecularWeight: 384.49516

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)C3=CC=CO3

Isomeric SMILES

CC(C)CN1C(=NN=C1SCC(=O)NCCC2=CC=CC=C2)C3=CC=CO3

InChI

InChI=1S/C20H24N4O2S/c1-15(2)13-24-19(17-9-6-12-26-17)22-23-20(24)27-14-18(25)21-11-10-16-7-4-3-5-8-16/h3-9,12,15H,10-11,13-14H2,1-2H3,(H,21,25)