5-(3,5-dimethyl-1-methylsulfonyl-pyrazol-4-yl)sulfanyl-1-phenyl-1,2,3,4-tetrazole

Systemtic Name: 5-(3,5-dimethyl-1-methylsulfonyl-pyrazol-4-yl)sulfanyl-1-phenyl-1,2,3,4-tetrazole Openeye Name: 5-(3,5-dimethyl-1-methylsulfonyl-pyrazol-4-yl)sulfanyl-1-phenyl-tetrazole CAS Name: 5-[(3,5-dimethyl-1-methylsulfonyl-4-pyrazolyl)thio]-1-phenyltetrazole IUPAC Name: 5-(3,5-dimethyl-1-methylsulfonylpyrazol-4-yl)sulfanyl-1-phenyltetrazole Traditional Name: 5-[(1-mesyl-3,5-dimethyl-pyrazol-4-yl)thio]-1-phenyl-tetrazole Formula: C13H14N6O2S2 MolecularWeight: 350.41926

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1S(=O)(=O)C)C)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=NN1S(=O)(=O)C)C)SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C13H14N6O2S2/c1-9-12(10(2)19(15-9)23(3,20)21)22-13-14-16-17-18(13)11-7-5-4-6-8-11/h4-8H,1-3H3