2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethylpent-1-yn-3-yl)ethanamide

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethylpent-1-yn-3-yl)ethanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(1,1-diethylprop-2-ynyl)acetamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(3-ethylpent-1-yn-3-yl)acetamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-(3-ethylpent-1-yn-3-yl)acetamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-(1,1-diethylprop-2-ynyl)acetamide Formula: C11H17N5OS MolecularWeight: 267.35058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17N5OS/c1-4-11(5-2,6-3)14-8(17)7-18-10-13-9(12)15-16-10/h1H,5-7H2,2-3H3,(H,14,17)(H3,12,13,15,16)