1-(4-methoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one

Systemtic Name: 1-(4-methoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-methoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-(4-methoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-(4-methoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-methoxyphenyl)-2-[(1-phenyl-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C18H17N3O2S MolecularWeight: 339.41148

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)C1=CC=C(C=C1)OC)SC2=NN(C=N2)C3=CC=CC=C3

Isomeric SMILES

CC(C(=O)C1=CC=C(C=C1)OC)SC2=NN(C=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H17N3O2S/c1-13(17(22)14-8-10-16(23-2)11-9-14)24-18-19-12-21(20-18)15-6-4-3-5-7-15/h3-13H,1-2H3