2-[5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]ethyl methanesulfonate

Systemtic Name: 2-[5-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]ethyl methanesulfonate Openeye Name: 2-[5-[(3-chloro-2-methyl-phenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]ethyl methanesulfonate CAS Name: methanesulfonic acid 2-[5-[(3-chloro-2-methylphenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]ethyl ester IUPAC Name: 2-[5-[(3-chloro-2-methylphenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]ethyl methanesulfonate Traditional Name: methanesulfonic acid 2-[5-[(3-chloro-2-methyl-phenyl)sulfonylamino]-1,3,4-thiadiazol-2-yl]ethyl ester Formula: C12H14ClN3O5S3 MolecularWeight: 411.90466

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=NN=C(S2)CCOS(=O)(=O)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=NN=C(S2)CCOS(=O)(=O)C

InChI

InChI=1S/C12H14ClN3O5S3/c1-8-9(13)4-3-5-10(8)24(19,20)16-12-15-14-11(22-12)6-7-21-23(2,17)18/h3-5H,6-7H2,1-2H3,(H,15,16)