2-(4-methylphenyl)sulfonylethyl (1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethanoate

Systemtic Name: 2-(4-methylphenyl)sulfonylethyl (1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethanoate Openeye Name: 2-(p-tolylsulfonyl)ethyl (1-phenyltetrazol-5-yl)sulfanylformate CAS Name: [(1-phenyl-5-tetrazolyl)thio]formic acid 2-(4-methylphenyl)sulfonylethyl ester IUPAC Name: 2-(4-methylphenyl)sulfonylethyl (1-phenyltetrazol-5-yl)sulfanylformate Traditional Name: [(1-phenyltetrazol-5-yl)thio]formic acid 2-tosylethyl ester Formula: C17H16N4O4S2 MolecularWeight: 404.46334

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)CCOC(=O)SC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)CCOC(=O)SC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C17H16N4O4S2/c1-13-7-9-15(10-8-13)27(23,24)12-11-25-17(22)26-16-18-19-20-21(16)14-5-3-2-4-6-14/h2-10H,11-12H2,1H3