2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxy-3-methyl-phenyl)ethanone

Systemtic Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxy-3-methyl-phenyl)ethanone Openeye Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxy-3-methyl-phenyl)ethanone CAS Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-1-(4-methoxy-3-methylphenyl)ethanone IUPAC Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)sulfanyl]-1-(4-methoxy-3-methylphenyl)ethanone Traditional Name: 2-[(5-ethyl-1H-1,2,4-triazol-3-yl)thio]-1-(4-methoxy-3-methyl-phenyl)ethanone Formula: C14H17N3O2S MolecularWeight: 291.36868

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC(=NN1)SCC(=O)C2=CC(=C(C=C2)OC)C

Isomeric SMILES

CCC1=NC(=NN1)SCC(=O)C2=CC(=C(C=C2)OC)C

InChI

InChI=1S/C14H17N3O2S/c1-4-13-15-14(17-16-13)20-8-11(18)10-5-6-12(19-3)9(2)7-10/h5-7H,4,8H2,1-3H3,(H,15,16,17)