5,7-ditert-butyl-2-(4-methylsulfanylphenyl)-1,3-benzoxazole

Systemtic Name: 5,7-ditert-butyl-2-(4-methylsulfanylphenyl)-1,3-benzoxazole Openeye Name: 5,7-ditert-butyl-2-(4-methylsulfanylphenyl)-1,3-benzoxazole CAS Name: 5,7-ditert-butyl-2-[4-(methylthio)phenyl]-1,3-benzoxazole IUPAC Name: 5,7-ditert-butyl-2-(4-methylsulfanylphenyl)-1,3-benzoxazole Traditional Name: 5,7-ditert-butyl-2-[4-(methylthio)phenyl]-1,3-benzoxazole Formula: C22H27NOS MolecularWeight: 353.52088

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)SC)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C2C(=C1)N=C(O2)C3=CC=C(C=C3)SC)C(C)(C)C

InChI

InChI=1S/C22H27NOS/c1-21(2,3)15-12-17(22(4,5)6)19-18(13-15)23-20(24-19)14-8-10-16(25-7)11-9-14/h8-13H,1-7H3