2-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-benzoxazole

Systemtic Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-benzoxazole Openeye Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-benzoxazole CAS Name: 2-[(2,5-dimethylphenyl)methylthio]-1,3-benzoxazole IUPAC Name: 2-[(2,5-dimethylphenyl)methylsulfanyl]-1,3-benzoxazole Traditional Name: 2-[(2,5-dimethylbenzyl)thio]-1,3-benzoxazole Formula: C16H15NOS MolecularWeight: 269.3614

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=NC3=CC=CC=C3O2

InChI

InChI=1S/C16H15NOS/c1-11-7-8-12(2)13(9-11)10-19-16-17-14-5-3-4-6-15(14)18-16/h3-9H,10H2,1-2H3