5-[3,5-dimethyl-1-(phenylsulfonyl)pyrazol-4-yl]sulfanyl-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-[3,5-dimethyl-1-(phenylsulfonyl)pyrazol-4-yl]sulfanyl-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-[1-(benzenesulfonyl)-3,5-dimethyl-pyrazol-4-yl]sulfanyl-1-phenyl-tetrazole CAS Name: 5-[[1-(benzenesulfonyl)-3,5-dimethyl-4-pyrazolyl]thio]-1-phenyltetrazole IUPAC Name: 5-[1-(benzenesulfonyl)-3,5-dimethylpyrazol-4-yl]sulfanyl-1-phenyltetrazole Traditional Name: 5-[(1-besyl-3,5-dimethyl-pyrazol-4-yl)thio]-1-phenyl-tetrazole Formula: C18H16N6O2S2 MolecularWeight: 412.48864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2)C)SC3=NN=NN3C4=CC=CC=C4

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C2=CC=CC=C2)C)SC3=NN=NN3C4=CC=CC=C4

InChI

InChI=1S/C18H16N6O2S2/c1-13-17(27-18-19-21-22-23(18)15-9-5-3-6-10-15)14(2)24(20-13)28(25,26)16-11-7-4-8-12-16/h3-12H,1-2H3