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

Systemtic Name: 3-ethoxy-1-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-ethoxy-1-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole CAS Name: 3-ethoxy-1-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-ethoxy-1-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-ethoxy-1-(4-mesylphenyl)-5-phenyl-1,2,4-triazole Formula: C17H17N3O3S MolecularWeight: 343.40018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=NN(C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCOC1=NN(C(=N1)C2=CC=CC=C2)C3=CC=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C17H17N3O3S/c1-3-23-17-18-16(13-7-5-4-6-8-13)20(19-17)14-9-11-15(12-10-14)24(2,21)22/h4-12H,3H2,1-2H3