2-[(4-azanyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenethyl-ethanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1N)SCC(=O)NCCC2=CC=CC=C2

Isomeric SMILES

CC1=NN=C(N1N)SCC(=O)NCCC2=CC=CC=C2

InChI

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