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

Systemtic Name: N-(2-cyanopropan-2-yl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-ethanamide Openeye Name: N-(1-cyano-1-methyl-ethyl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methyl-acetamide CAS Name: N-(2-cyanopropan-2-yl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-methylacetamide IUPAC Name: N-(2-cyanopropan-2-yl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-methylacetamide Traditional Name: N-(1-cyano-1-methyl-ethyl)-2-[(4-ethyl-5-phenyl-1,2,4-triazol-3-yl)thio]-N-methyl-acetamide Formula: C17H21N5OS MolecularWeight: 343.44654

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=NN=C1SCC(=O)N(C)C(C)(C)C#N)C2=CC=CC=C2

Isomeric SMILES

CCN1C(=NN=C1SCC(=O)N(C)C(C)(C)C#N)C2=CC=CC=C2

InChI

InChI=1S/C17H21N5OS/c1-5-22-15(13-9-7-6-8-10-13)19-20-16(22)24-11-14(23)21(4)17(2,3)12-18/h6-10H,5,11H2,1-4H3