N-(1-cyanocyclohexyl)-2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[[4-(2-furylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[[4-(2-furanylmethyl)-1,2,4-triazol-3-yl]thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[[4-(furan-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[[4-(2-furfuryl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C17H21N5O2S MolecularWeight: 359.44594

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NN=CN1CC2=CC=CO2)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)CSC1=NN=CN1CC2=CC=CO2)C3(CCCCC3)C#N

InChI

InChI=1S/C17H21N5O2S/c1-21(17(12-18)7-3-2-4-8-17)15(23)11-25-16-20-19-13-22(16)10-14-6-5-9-24-14/h5-6,9,13H,2-4,7-8,10-11H2,1H3