1-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]propan-1-one

Systemtic Name: 1-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]propan-1-one Openeye Name: 1-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]propan-1-one CAS Name: 1-[3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-1-yl]-1-propanone IUPAC Name: 1-[3-(4-methoxyphenyl)-5-methylsulfanyl-1,2,4-triazol-1-yl]propan-1-one Traditional Name: 1-[3-(4-methoxyphenyl)-5-(methylthio)-1,2,4-triazol-1-yl]propan-1-one Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)OC)SC

Isomeric SMILES

CCC(=O)N1C(=NC(=N1)C2=CC=C(C=C2)OC)SC

InChI

InChI=1S/C13H15N3O2S/c1-4-11(17)16-13(19-3)14-12(15-16)9-5-7-10(18-2)8-6-9/h5-8H,4H2,1-3H3