N-methyl-2-[[4-(oxolan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide

Systemtic Name: N-methyl-2-[[4-(oxolan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]ethanamide Openeye Name: N-methyl-2-[[5-phenyl-4-(tetrahydrofuran-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-methyl-2-[[4-(2-oxolanylmethyl)-5-phenyl-1,2,4-triazol-3-yl]thio]acetamide IUPAC Name: N-methyl-2-[[4-(oxolan-2-ylmethyl)-5-phenyl-1,2,4-triazol-3-yl]sulfanyl]acetamide Traditional Name: N-methyl-2-[[5-phenyl-4-(tetrahydrofurfuryl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C16H20N4O2S MolecularWeight: 332.4206

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Descriptors Computed from Structure

Canonical SMILES:

CNC(=O)CSC1=NN=C(N1CC2CCCO2)C3=CC=CC=C3

Isomeric SMILES

CNC(=O)CSC1=NN=C(N1CC2CCCO2)C3=CC=CC=C3

InChI

InChI=1S/C16H20N4O2S/c1-17-14(21)11-23-16-19-18-15(12-6-3-2-4-7-12)20(16)10-13-8-5-9-22-13/h2-4,6-7,13H,5,8-11H2,1H3,(H,17,21)