2-[(4-tert-butylphenyl)methylsulfanyl]-7-chloranyl-5-fluoranyl-1,3-benzoxazole

Systemtic Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-7-chloranyl-5-fluoranyl-1,3-benzoxazole Openeye Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-7-chloro-5-fluoro-1,3-benzoxazole CAS Name: 2-[(4-tert-butylphenyl)methylthio]-7-chloro-5-fluoro-1,3-benzoxazole IUPAC Name: 2-[(4-tert-butylphenyl)methylsulfanyl]-7-chloro-5-fluoro-1,3-benzoxazole Traditional Name: 2-[(4-tert-butylbenzyl)thio]-7-chloro-5-fluoro-1,3-benzoxazole Formula: C18H17ClFNOS MolecularWeight: 349.850083

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC(=CC(=C3O2)Cl)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CSC2=NC3=CC(=CC(=C3O2)Cl)F

InChI

InChI=1S/C18H17ClFNOS/c1-18(2,3)12-6-4-11(5-7-12)10-23-17-21-15-9-13(20)8-14(19)16(15)22-17/h4-9H,10H2,1-3H3