2-[(4-methylsulfanylphenyl)methyl]-5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazole

Systemtic Name: 2-[(4-methylsulfanylphenyl)methyl]-5-(4-propan-2-ylphenyl)-1,2,3,4-tetrazole Openeye Name: 5-(4-isopropylphenyl)-2-[(4-methylsulfanylphenyl)methyl]tetrazole CAS Name: 2-[[4-(methylthio)phenyl]methyl]-5-(4-propan-2-ylphenyl)tetrazole IUPAC Name: 2-[(4-methylsulfanylphenyl)methyl]-5-(4-propan-2-ylphenyl)tetrazole Traditional Name: 2-[4-(methylthio)benzyl]-5-p-cumenyl-tetrazole Formula: C18H20N4S MolecularWeight: 324.4432

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NN(N=N2)CC3=CC=C(C=C3)SC

InChI

InChI=1S/C18H20N4S/c1-13(2)15-6-8-16(9-7-15)18-19-21-22(20-18)12-14-4-10-17(23-3)11-5-14/h4-11,13H,12H2,1-3H3