1-(5-methylsulfonyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)propan-1-one

Systemtic Name: 1-(5-methylsulfonyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)propan-1-one Openeye Name: 1-(5-methylsulfonyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)propan-1-one CAS Name: 1-(5-methylsulfonyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)-1-propanone IUPAC Name: 1-(5-methylsulfonyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)propan-1-one Traditional Name: 1-(5-mesyl-2-phenyl-2H-1,3,4-thiadiazol-3-yl)propan-1-one Formula: C12H14N2O3S2 MolecularWeight: 298.38116

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N1C(SC(=N1)S(=O)(=O)C)C2=CC=CC=C2

Isomeric SMILES

CCC(=O)N1C(SC(=N1)S(=O)(=O)C)C2=CC=CC=C2

InChI

InChI=1S/C12H14N2O3S2/c1-3-10(15)14-11(9-7-5-4-6-8-9)18-12(13-14)19(2,16)17/h4-8,11H,3H2,1-2H3