2-[2-(4-tert-butylphenyl)sulfonylethylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[2-(4-tert-butylphenyl)sulfonylethylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[2-(4-tert-butylphenyl)sulfonylethylsulfanyl]-1,3-benzoxazole CAS Name: 2-[2-(4-tert-butylphenyl)sulfonylethylthio]-1,3-benzoxazole IUPAC Name: 2-[2-(4-tert-butylphenyl)sulfonylethylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[2-(4-tert-butylphenyl)sulfonylethylthio]-1,3-benzoxazole Formula: C19H21NO3S2 MolecularWeight: 375.50494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)CCSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)S(=O)(=O)CCSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C19H21NO3S2/c1-19(2,3)14-8-10-15(11-9-14)25(21,22)13-12-24-18-20-16-6-4-5-7-17(16)23-18/h4-11H,12-13H2,1-3H3