2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(tert-butylcarbamoyl)ethanamide

Systemtic Name: 2-[(4-azanyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(tert-butylcarbamoyl)ethanamide Openeye Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(tert-butylcarbamoyl)acetamide CAS Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]-N-[(tert-butylamino)-oxomethyl]acetamide IUPAC Name: 2-[(4-amino-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]-N-(tert-butylcarbamoyl)acetamide Traditional Name: 2-[[4-amino-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]-N-(tert-butylcarbamoyl)acetamide Formula: C13H18N6O2S2 MolecularWeight: 354.45102

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)NC(=O)CSC1=NN=C(N1N)C2=CC=CS2

Isomeric SMILES

CC(C)(C)NC(=O)NC(=O)CSC1=NN=C(N1N)C2=CC=CS2

InChI

InChI=1S/C13H18N6O2S2/c1-13(2,3)16-11(21)15-9(20)7-23-12-18-17-10(19(12)14)8-5-4-6-22-8/h4-6H,7,14H2,1-3H3,(H2,15,16,20,21)