2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyanothiophen-2-yl)ethanamide

Systemtic Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyanothiophen-2-yl)ethanamide Openeye Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyano-2-thienyl)acetamide CAS Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(3-cyano-2-thiophenyl)acetamide IUPAC Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-cyanothiophen-2-yl)acetamide Traditional Name: 2-[(5-tert-butyl-1H-1,2,4-triazol-3-yl)thio]-N-(3-cyano-2-thienyl)acetamide Formula: C13H15N5OS2 MolecularWeight: 321.4211

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NC(=NN1)SCC(=O)NC2=C(C=CS2)C#N

Isomeric SMILES

CC(C)(C)C1=NC(=NN1)SCC(=O)NC2=C(C=CS2)C#N

InChI

InChI=1S/C13H15N5OS2/c1-13(2,3)11-16-12(18-17-11)21-7-9(19)15-10-8(6-14)4-5-20-10/h4-5H,7H2,1-3H3,(H,15,19)(H,16,17,18)