1-(2,6-dimethylphenyl)-5-[(4-imidazol-1-ylphenyl)methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-(2,6-dimethylphenyl)-5-[(4-imidazol-1-ylphenyl)methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-(2,6-dimethylphenyl)-5-[(4-imidazol-1-ylphenyl)methylsulfanyl]tetrazole CAS Name: 1-(2,6-dimethylphenyl)-5-[[4-(1-imidazolyl)phenyl]methylthio]tetrazole IUPAC Name: 1-(2,6-dimethylphenyl)-5-[(4-imidazol-1-ylphenyl)methylsulfanyl]tetrazole Traditional Name: 1-(2,6-dimethylphenyl)-5-[(4-imidazol-1-ylbenzyl)thio]tetrazole Formula: C19H18N6S MolecularWeight: 362.45142

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SCC3=CC=C(C=C3)N4C=CN=C4

Isomeric SMILES

CC1=C(C(=CC=C1)C)N2C(=NN=N2)SCC3=CC=C(C=C3)N4C=CN=C4

InChI

InChI=1S/C19H18N6S/c1-14-4-3-5-15(2)18(14)25-19(21-22-23-25)26-12-16-6-8-17(9-7-16)24-11-10-20-13-24/h3-11,13H,12H2,1-2H3