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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)C(=O)CCSC2=NN=C(N2C3=CC=CC=C3)C

Isomeric SMILES

CC1=CC(=C(C=C1)O)C(=O)CCSC2=NN=C(N2C3=CC=CC=C3)C

InChI

InChI=1S/C19H19N3O2S/c1-13-8-9-17(23)16(12-13)18(24)10-11-25-19-21-20-14(2)22(19)15-6-4-3-5-7-15/h3-9,12,23H,10-11H2,1-2H3