1-(3,5-dimethylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,3,4-tetrazole

Systemtic Name: 1-(3,5-dimethylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]-1,2,3,4-tetrazole Openeye Name: 1-(3,5-dimethylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]tetrazole CAS Name: 1-(3,5-dimethylphenyl)-5-[[4-(methylthio)phenyl]methylthio]tetrazole IUPAC Name: 1-(3,5-dimethylphenyl)-5-[(4-methylsulfanylphenyl)methylsulfanyl]tetrazole Traditional Name: 1-(3,5-dimethylphenyl)-5-[[4-(methylthio)benzyl]thio]tetrazole Formula: C17H18N4S2 MolecularWeight: 342.48162

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4S2/c1-12-8-13(2)10-15(9-12)21-17(18-19-20-21)23-11-14-4-6-16(22-3)7-5-14/h4-10H,11H2,1-3H3