3-cyclohexyl-2H-1,3-benzothiazole-2-sulfinate

Systemtic Name: 3-cyclohexyl-2H-1,3-benzothiazole-2-sulfinate Openeye Name: 3-cyclohexyl-2H-1,3-benzothiazole-2-sulfinate CAS Name: 3-cyclohexyl-2H-1,3-benzothiazole-2-sulfinate IUPAC Name: 3-cyclohexyl-2H-1,3-benzothiazole-2-sulfinate Traditional Name: 3-cyclohexyl-2H-1,3-benzothiazole-2-sulfinate Formula: C13H16NO2S2- MolecularWeight: 282.40164

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(SC3=CC=CC=C32)S(=O)[O-]

Isomeric SMILES

C1CCC(CC1)N2C(SC3=CC=CC=C32)S(=O)[O-]

InChI

InChI=1S/C13H17NO2S2/c15-18(16)13-14(10-6-2-1-3-7-10)11-8-4-5-9-12(11)17-13/h4-5,8-10,13H,1-3,6-7H2,(H,15,16)/p-1