N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-[(2S)-2-cyano-3-methyl-butan-2-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-[(2S)-2-cyano-3-methylbutan-2-yl]-2-[(5-thiophen-2-yl-1H-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-[(1S)-1-cyano-1,2-dimethyl-propyl]-2-[[5-(2-thienyl)-1H-1,2,4-triazol-3-yl]thio]acetamide Formula: C14H17N5OS2 MolecularWeight: 335.44768

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C)(C#N)NC(=O)CSC1=NNC(=N1)C2=CC=CS2

Isomeric SMILES

CC(C)[C@@](C)(C#N)NC(=O)CSC1=NNC(=N1)C2=CC=CS2

InChI

InChI=1S/C14H17N5OS2/c1-9(2)14(3,8-15)17-11(20)7-22-13-16-12(18-19-13)10-5-4-6-21-10/h4-6,9H,7H2,1-3H3,(H,17,20)(H,16,18,19)/t14-/m1/s1