2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-phenethyl-ethanamide

Systemtic Name: 2-(3-azanyl-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-phenethyl-ethanamide Openeye Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-phenethyl-acetamide CAS Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-phenethylacetamide IUPAC Name: 2-(3-amino-5-methylsulfanyl-1,2,4-triazol-4-yl)-N-phenethylacetamide Traditional Name: 2-[3-amino-5-(methylthio)-1,2,4-triazol-4-yl]-N-phenethyl-acetamide Formula: C13H17N5OS MolecularWeight: 291.37198

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NN=C(N1CC(=O)NCCC2=CC=CC=C2)N

Isomeric SMILES

CSC1=NN=C(N1CC(=O)NCCC2=CC=CC=C2)N

InChI

InChI=1S/C13H17N5OS/c1-20-13-17-16-12(14)18(13)9-11(19)15-8-7-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H2,14,16)(H,15,19)