1-(3,5-dimethylphenyl)-5-(1-phenylethylsulfanyl)-1,2,3,4-tetrazole

Systemtic Name: 1-(3,5-dimethylphenyl)-5-(1-phenylethylsulfanyl)-1,2,3,4-tetrazole Openeye Name: 1-(3,5-dimethylphenyl)-5-(1-phenylethylsulfanyl)tetrazole CAS Name: 1-(3,5-dimethylphenyl)-5-(1-phenylethylthio)tetrazole IUPAC Name: 1-(3,5-dimethylphenyl)-5-(1-phenylethylsulfanyl)tetrazole Traditional Name: 1-(3,5-dimethylphenyl)-5-(1-phenylethylthio)tetrazole Formula: C17H18N4S MolecularWeight: 310.41662

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H18N4S/c1-12-9-13(2)11-16(10-12)21-17(18-19-20-21)22-14(3)15-7-5-4-6-8-15/h4-11,14H,1-3H3