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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butyl-propanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butyl-propanamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-tert-butylpropanamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-tert-butylpropanamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-tert-butyl-propionamide Formula: C9H17N5OS MolecularWeight: 243.32918

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(C)(C)C)SC1=NNC(=N1)N

Isomeric SMILES

CC(C(=O)NC(C)(C)C)SC1=NNC(=N1)N

InChI

InChI=1S/C9H17N5OS/c1-5(6(15)12-9(2,3)4)16-8-11-7(10)13-14-8/h5H,1-4H3,(H,12,15)(H3,10,11,13,14)