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

Systemtic Name: 3-ethylsulfanyl-4-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole Openeye Name: 3-ethylsulfanyl-4-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole CAS Name: 3-(ethylthio)-4-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole IUPAC Name: 3-ethylsulfanyl-4-(4-methylsulfonylphenyl)-5-phenyl-1,2,4-triazole Traditional Name: 3-(ethylthio)-4-(4-mesylphenyl)-5-phenyl-1,2,4-triazole Formula: C17H17N3O2S2 MolecularWeight: 359.46578

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(N1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

Isomeric SMILES

CCSC1=NN=C(N1C2=CC=C(C=C2)S(=O)(=O)C)C3=CC=CC=C3

InChI

InChI=1S/C17H17N3O2S2/c1-3-23-17-19-18-16(13-7-5-4-6-8-13)20(17)14-9-11-15(12-10-14)24(2,21)22/h4-12H,3H2,1-2H3