4-[5-[(2,5-dimethylphenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]phenol

Systemtic Name: 4-[5-[(2,5-dimethylphenyl)methylsulfanyl]-1,2,3,4-tetrazol-1-yl]phenol Openeye Name: 4-[5-[(2,5-dimethylphenyl)methylsulfanyl]tetrazol-1-yl]phenol CAS Name: 4-[5-[(2,5-dimethylphenyl)methylthio]-1-tetrazolyl]phenol IUPAC Name: 4-[5-[(2,5-dimethylphenyl)methylsulfanyl]tetrazol-1-yl]phenol Traditional Name: 4-[5-[(2,5-dimethylbenzyl)thio]tetrazol-1-yl]phenol Formula: C16H16N4OS MolecularWeight: 312.38944

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NN=NN2C3=CC=C(C=C3)O

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NN=NN2C3=CC=C(C=C3)O

InChI

InChI=1S/C16H16N4OS/c1-11-3-4-12(2)13(9-11)10-22-16-17-18-19-20(16)14-5-7-15(21)8-6-14/h3-9,21H,10H2,1-2H3