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

Systemtic Name: 1-(4-methoxyphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Openeye Name: 1-(4-methoxyphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one CAS Name: 1-(4-methoxyphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-1-propanone IUPAC Name: 1-(4-methoxyphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]propan-1-one Traditional Name: 1-(4-methoxyphenyl)-2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]propan-1-one Formula: C19H19N3O2S MolecularWeight: 353.43806

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC(C)C(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SC(C)C(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C19H19N3O2S/c1-13(18(23)15-9-11-17(24-3)12-10-15)25-19-21-20-14(2)22(19)16-7-5-4-6-8-16/h4-13H,1-3H3