1-(1-ethanoyl-5-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)ethanone

Systemtic Name: 1-(1-ethanoyl-5-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)ethanone Openeye Name: 1-(1-acetyl-5-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)ethanone CAS Name: 1-[1-acetyl-5-methyl-3-(methylthio)-5-phenyl-1,2,4-triazol-4-yl]ethanone IUPAC Name: 1-(1-acetyl-5-methyl-3-methylsulfanyl-5-phenyl-1,2,4-triazol-4-yl)ethanone Traditional Name: 1-[1-acetyl-5-methyl-3-(methylthio)-5-phenyl-1,2,4-triazol-4-yl]ethanone Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1C(=NN(C1(C)C2=CC=CC=C2)C(=O)C)SC

Isomeric SMILES

CC(=O)N1C(=NN(C1(C)C2=CC=CC=C2)C(=O)C)SC

InChI

InChI=1S/C14H17N3O2S/c1-10(18)16-13(20-4)15-17(11(2)19)14(16,3)12-8-6-5-7-9-12/h5-9H,1-4H3