2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-chloranyl-1,3-benzoxazole

Systemtic Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-chloranyl-1,3-benzoxazole Openeye Name: 2-[(4-tert-butyl-2,6-dimethyl-phenyl)methylsulfanyl]-5-chloro-1,3-benzoxazole CAS Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylthio]-5-chloro-1,3-benzoxazole IUPAC Name: 2-[(4-tert-butyl-2,6-dimethylphenyl)methylsulfanyl]-5-chloro-1,3-benzoxazole Traditional Name: 2-[(4-tert-butyl-2,6-dimethyl-benzyl)thio]-5-chloro-1,3-benzoxazole Formula: C20H22ClNOS MolecularWeight: 359.91278

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1CSC2=NC3=C(O2)C=CC(=C3)Cl)C)C(C)(C)C

Isomeric SMILES

CC1=CC(=CC(=C1CSC2=NC3=C(O2)C=CC(=C3)Cl)C)C(C)(C)C

InChI

InChI=1S/C20H22ClNOS/c1-12-8-14(20(3,4)5)9-13(2)16(12)11-24-19-22-17-10-15(21)6-7-18(17)23-19/h6-10H,11H2,1-5H3