N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide

Systemtic Name: N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-ethanamide Openeye Name: N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-methyl-acetamide CAS Name: N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-methylacetamide IUPAC Name: N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]sulfanyl]-N-methylacetamide Traditional Name: N-(1-cyanocyclohexyl)-2-[[5-(4-methoxyphenyl)-1H-1,2,4-triazol-3-yl]thio]-N-methyl-acetamide Formula: C19H23N5O2S MolecularWeight: 385.48322

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(=O)CSC1=NNC(=N1)C2=CC=C(C=C2)OC)C3(CCCCC3)C#N

Isomeric SMILES

CN(C(=O)CSC1=NNC(=N1)C2=CC=C(C=C2)OC)C3(CCCCC3)C#N

InChI

InChI=1S/C19H23N5O2S/c1-24(19(13-20)10-4-3-5-11-19)16(25)12-27-18-21-17(22-23-18)14-6-8-15(26-2)9-7-14/h6-9H,3-5,10-12H2,1-2H3,(H,21,22,23)