3-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)-1H-1,2,4-triazol-5-one

Systemtic Name: 3-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)-1H-1,2,4-triazol-5-one Openeye Name: 3-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)-1H-1,2,4-triazol-5-one CAS Name: 3-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)-1H-1,2,4-triazol-5-one IUPAC Name: 3-(4-methoxyphenyl)-2-(4-methylsulfonylphenyl)-1H-1,2,4-triazol-5-one Traditional Name: 2-(4-mesylphenyl)-3-(4-methoxyphenyl)-1H-1,2,4-triazol-5-one Formula: C16H15N3O4S MolecularWeight: 345.373

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC(=O)NN2C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC(=O)NN2C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C16H15N3O4S/c1-23-13-7-3-11(4-8-13)15-17-16(20)18-19(15)12-5-9-14(10-6-12)24(2,21)22/h3-10H,1-2H3,(H,18,20)