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

Systemtic Name: 2-[(5-azanyl-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-ynyl-propanamide Openeye Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-ynyl-propanamide CAS Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-prop-2-ynylpropanamide IUPAC Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)sulfanyl]-N-prop-2-ynylpropanamide Traditional Name: 2-[(5-amino-1H-1,2,4-triazol-3-yl)thio]-N-propargyl-propionamide Formula: C8H11N5OS MolecularWeight: 225.27084

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NCC#C)SC1=NNC(=N1)N

Isomeric SMILES

CC(C(=O)NCC#C)SC1=NNC(=N1)N

InChI

InChI=1S/C8H11N5OS/c1-3-4-10-6(14)5(2)15-8-11-7(9)12-13-8/h1,5H,4H2,2H3,(H,10,14)(H3,9,11,12,13)