2-[2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-methyl-amino]-N-methyl-ethanamide

Systemtic Name: 2-[2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]ethanoyl-methyl-amino]-N-methyl-ethanamide Openeye Name: 2-[[2-[[4-(2-furylmethyl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methyl-amino]-N-methyl-acetamide CAS Name: 2-[[2-[[4-(2-furanylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]-1-oxoethyl]-methylamino]-N-methylacetamide IUPAC Name: 2-[[2-[[4-(furan-2-ylmethyl)-5-pyridin-3-yl-1,2,4-triazol-3-yl]sulfanyl]acetyl]-methylamino]-N-methylacetamide Traditional Name: 2-[[2-[[4-(2-furfuryl)-5-(3-pyridyl)-1,2,4-triazol-3-yl]thio]acetyl]-methyl-amino]-N-methyl-acetamide Formula: C18H20N6O3S MolecularWeight: 400.4548

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CN(C)C(=O)CSC1=NN=C(N1CC2=CC=CO2)C3=CN=CC=C3

Isomeric SMILES

CNC(=O)CN(C)C(=O)CSC1=NN=C(N1CC2=CC=CO2)C3=CN=CC=C3

InChI

InChI=1S/C18H20N6O3S/c1-19-15(25)11-23(2)16(26)12-28-18-22-21-17(13-5-3-7-20-9-13)24(18)10-14-6-4-8-27-14/h3-9H,10-12H2,1-2H3,(H,19,25)