2-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-6-methylsulfonyl-1,3-benzothiazole

Systemtic Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-6-methylsulfonyl-1,3-benzothiazole Openeye Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-6-methylsulfonyl-1,3-benzothiazole CAS Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)thio]-6-methylsulfonyl-1,3-benzothiazole IUPAC Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)sulfanyl]-6-methylsulfonyl-1,3-benzothiazole Traditional Name: 2-[(5-ethyl-1,3,4-thiadiazol-2-yl)thio]-6-mesyl-1,3-benzothiazole Formula: C12H11N3O2S4 MolecularWeight: 357.49464

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN=C(S1)SC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

Isomeric SMILES

CCC1=NN=C(S1)SC2=NC3=C(S2)C=C(C=C3)S(=O)(=O)C

InChI

InChI=1S/C12H11N3O2S4/c1-3-10-14-15-12(19-10)20-11-13-8-5-4-7(21(2,16)17)6-9(8)18-11/h4-6H,3H2,1-2H3