3-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-1,2,4-triazole

Systemtic Name: 3-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-1,2,4-triazole Openeye Name: 3-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-1,2,4-triazole CAS Name: 3-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-1,2,4-triazole IUPAC Name: 3-methyl-5-(4-methylsulfonylphenyl)-1-phenyl-1,2,4-triazole Traditional Name: 5-(4-mesylphenyl)-3-methyl-1-phenyl-1,2,4-triazole Formula: C16H15N3O2S MolecularWeight: 313.3742

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=N1)C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C16H15N3O2S/c1-12-17-16(19(18-12)14-6-4-3-5-7-14)13-8-10-15(11-9-13)22(2,20)21/h3-11H,1-2H3