phenyl 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanesulfonate

Systemtic Name: phenyl 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanesulfonate Openeye Name: phenyl 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanesulfonate CAS Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethanesulfonic acid phenyl ester IUPAC Name: phenyl 2-[(5-methyl-1,3,4-thiadiazol-2-yl)sulfanyl]ethanesulfonate Traditional Name: 2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethanesulfonic acid phenyl ester Formula: C11H12N2O3S3 MolecularWeight: 316.41958

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(S1)SCCS(=O)(=O)OC2=CC=CC=C2

Isomeric SMILES

CC1=NN=C(S1)SCCS(=O)(=O)OC2=CC=CC=C2

InChI

InChI=1S/C11H12N2O3S3/c1-9-12-13-11(18-9)17-7-8-19(14,15)16-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3