N-(1-cyanocyclohexyl)-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[[4-cyclopropyl-5-(2-thienylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[[4-cyclopropyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[[4-cyclopropyl-5-(2-thenyl)-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C20H25N5OS2 MolecularWeight: 415.5754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NN=C(N1C2CC2)CC3=CC=CS3)C4(CCCCC4)C#N

Isomeric SMILES

CN(C(=O)CSC1=NN=C(N1C2CC2)CC3=CC=CS3)C4(CCCCC4)C#N

InChI

InChI=1S/C20H25N5OS2/c1-24(20(14-21)9-3-2-4-10-20)18(26)13-28-19-23-22-17(25(19)15-7-8-15)12-16-6-5-11-27-16/h5-6,11,15H,2-4,7-10,12-13H2,1H3