1-(3,4-dimethylphenyl)-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-(3,4-dimethylphenyl)-5-[(3-fluoranyl-4-methoxy-phenyl)methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-(3,4-dimethylphenyl)-5-[(3-fluoro-4-methoxy-phenyl)methylsulfanyl]tetrazole CAS Name: 1-(3,4-dimethylphenyl)-5-[(3-fluoro-4-methoxyphenyl)methylthio]tetrazole IUPAC Name: 1-(3,4-dimethylphenyl)-5-[(3-fluoro-4-methoxyphenyl)methylsulfanyl]tetrazole Traditional Name: 1-(3,4-dimethylphenyl)-5-[(3-fluoro-4-methoxy-benzyl)thio]tetrazole Formula: C17H17FN4OS MolecularWeight: 344.406483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)N2C(=NN=N2)SCC3=CC(=C(C=C3)OC)F)C

Isomeric SMILES

CC1=C(C=C(C=C1)N2C(=NN=N2)SCC3=CC(=C(C=C3)OC)F)C

InChI

InChI=1S/C17H17FN4OS/c1-11-4-6-14(8-12(11)2)22-17(19-20-21-22)24-10-13-5-7-16(23-3)15(18)9-13/h4-9H,10H2,1-3H3