2-[(4-azanyl-5-phenyl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]ethanamide

Systemtic Name: 2-[(4-azanyl-5-phenyl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]ethanamide Openeye Name: 2-[(4-amino-5-phenyl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]acetamide CAS Name: 2-[(4-amino-5-phenyl-1H-1,2,4-triazol-4-ium-3-yl)thio]acetamide IUPAC Name: 2-[(4-amino-5-phenyl-1H-1,2,4-triazol-4-ium-3-yl)sulfanyl]acetamide Traditional Name: 2-[(4-amino-5-phenyl-1H-1,2,4-triazol-4-ium-3-yl)thio]acetamide Formula: C10H12N5OS+ MolecularWeight: 250.30018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=[N+](C(=NN2)SCC(=O)N)N

Isomeric SMILES

C1=CC=C(C=C1)C2=[N+](C(=NN2)SCC(=O)N)N

InChI

InChI=1S/C10H11N5OS/c11-8(16)6-17-10-14-13-9(15(10)12)7-4-2-1-3-5-7/h1-5H,6,12H2,(H2,11,16)/p+1